Cyclopentanone

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2017-10-12 21h:18m:41s (EST)

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2017-10-12 21h:23m:06s (EST)

O

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Reaxys ID 605573 View in Reaxys

1/1 CAS Registry Number: 120-92-3 Chemical Name: cyclopentanone Linear Structure Formula: (CH2)4C(O) Molecular Formula: C5H8O Molecular Weight: 84.1179 Type of Substance: isocyclic InChI Key: BGTOWKSIORTVQH-UHFFFAOYSA-N Note:

O

Substance Label (213) Label References 1a

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(2S,1'S)-13m

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2c

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Sugahara, Kosei; Kimura, Toshihiro; Kamata, Keigo; Yamaguchi, Kazuya; Mizuno, Noritaka; Chemical Communications; vol. 48; nb. 67; (2012); p. 8422 - 8424, View in Reaxys; Scheffler, Ulf; Mahrwald, Rainer; Helvetica Chimica Acta; vol. 95; nb. 10; (2012); p. 1970 - 1975,6, View in Reaxys; Rezaei-Seresht, Esmail; Tayebee, Reza; Yasemi, Mohammad; Synthetic Communications; vol. 43; nb. 13; (2013); p. 1859 - 1864, View in Reaxys; Bandyopadhyay, Prabal; Prasad; Sathe, Manisha; Sharma, Pratibha; Kumar, Ashok; Kaushik; RSC Advances; vol. 4; nb. 13; (2014); p. 6638 - 6645, View in Reaxys; Chu, Xue-Qiang; Meng, Hua; Zi, You; Xu, Xiao-Ping; Ji, Shun-Jun; Chemistry - A European Journal; vol. 20; nb. 51; (2014); p.

17198 - 17206, View in Reaxys

6c

Banon-Caballero, Abraham; Guillena, Gabriela; Najera, Carmen; Helvetica Chimica Acta; vol. 95; nb. 10; (2012); p. 1831 - 1841,11, View in Reaxys; Bañõn-Caballero, Abraham; Guillena, Gabriela; Nájera, Carmen; Helvetica Chimica Acta; vol. 95; nb. 10; (2012); p. 1831 - 1841, View in Reaxys; Edayadulla, Naushad; Lee, Yong Rok; RSC Advances; vol. 4; nb. 22; (2014); p. 11459 - 11468, View in Reaxys

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8b

Paladhi, Sushovan; Das, Joydeb; Mishra, Pratyush Kumar; Dash, Jyotirmayee; Advanced Synthesis and Catalysis; vol. 355; nb. 2-3; (2013); p. 274 - 280, View in Reaxys; Liu, Lingyan; Zhu, Yunna; Huang, Kaimeng; Chang, Weixing; Li, Jing; European Journal of Organic Chemistry; nb. 13; (2013); p. 2634 2645, View in Reaxys; Wan, Wen; Gao, Wei; Ma, Guobin; Ma, Lei; Wang, Fan; Wang, Jing; Jiang, Haizhen; Zhu, Shizheng; Hao, Jian; RSC Advances; vol. 4; nb. 51; (2014); p. 26563 - 26568, View in Reaxys

b

Xu; Cao; Ma; Peng; Asian Journal of Chemistry; vol. 25; nb. 7; (2013); p. 3847 - 3849, View in Reaxys; Rafikova, Khadichakhan; Kystaubayeva, Nurzhamal; Aydemir, Murat; Kayan, Cezmi; Ocak, Yusuf Selim; Temel, Hamdi; Zazybin, Alexey; Guerbuez, Nevin; Oezdemir, Ismail; Journal of Organometallic Chemistry; vol. 758; (2014); p. 1 - 8, View in Reaxys

14b

Kusakabe, Ken-Ichi; Iso, Yasuyoshi; Tada, Yukio; Sakagami, Masahiro; Morioka, Yasuhide; Chomei, Nobuo; Shinonome, Satomi; Kawamoto, Keiko; Takenaka, Hideyuki; Yasui, Kiyoshi; Hamana, Hiroshi; Hanasaki, Kohji; Bioorganic and Medicinal Chemistry; vol. 21; nb. 11; (2013); p. 3154 - 3163, View in Reaxys; Rivas, Veronica M.; Munive, Laura; Olivo, Horacio F.; Synlett; vol. 25; nb. 6; (2014); p.

876 - 880; Art.No: 617, View in Reaxys

5i

Sakthivel, Karuppusamy; Srinivasan, Kannupal; Organic and Biomolecular Chemistry; vol. 12; nb. 2; (2014); p. 269 - 277, View in Reaxys

2-a

Patent; PHARMASCIENCE INC.; LAURENT, Alain; ROSE, Yannick; WO2014/5217; (2014); (A1) English, View in Reaxys

1.1

Patent; NIMBUS IRIS, INC.; HARRIMAN, Geraldine C.; WESTER, Ronald T.; ROMERO, Donna L.; MASSE, Craig E.; ROBINSON, Shaughnessy; GREENWOOD, Jeremy Robert; WO2014/11906; (2014); (A2) English, View in Reaxys; Patent; Nimbus Iris, Inc.; Greenwood, Jeremy Robert; Harriman, Geraldine C.; Kapeller-Libermann, Rosana; Masse, Craig E.; Robinson, Shaughnessy; Romero, Donna L.; Shelley, Mee; Wester, Ronald T.; US2014/194417; (2014); (A1) English, View in Reaxys

13f

Psarra, Anastasia; Kokotos, Christoforos G.; Moutevelis-Minakakis, Panagiota; Tetrahedron; vol. 70; nb. 3; (2014); p. 608 - 615, View in Reaxys

2l

Paul, Caroline E.; Lavandera, Ivan; Gotor-Fernandez, Vicente; Kroutil, Wolfgang; Gotor, Vicente; ChemCatChem; vol. 5; nb. 12; (2013); p. 3875 - 3881, View in Reaxys; Wang, Dao-Lin; Wu, Jian-Ying; Cui, Qing-Tao; Chinese Chemical Letters; vol. 25; nb. 12; (2014); p. 1591 - 1594, View in Reaxys

1p

Lv, Yunhe; Li, Yan; Xiong, Tao; Lu, Yu; Liu, Qun; Zhang, Qian; Chemical Communications; vol. 50; nb.

18; (2014); p. 2367 - 2369, View in Reaxys

OLI0008

Patent; OLFACTOR LABORATORIES INCORPORATED; BROWN, Michelle, Ardella; LOMELI, Martin, Antonio, Jr.; ELKASHEF, Samer; ZION, Tricia; FRUTOS, Ulises; WO2014/28835; (2014); (A2) English, View in Reaxys

6p

Novak, Ana; Stefanic, Matej; Groselj, Uros; Hrast, Martina; Kasunic, Marta; Gobec, Stanislav; Stanovnik, Branko; Svete, Jurij; Helvetica Chimica Acta; vol. 97; nb. 2; (2014); p. 245 - 267, View in Reaxys

36b

Atobe, Masakazu; Naganuma, Kenji; Kawanishi, Masashi; Morimoto, Akifumi; Kasahara, Ken-Ichi; Ohashi, Shigeki; Suzuki, Hiroko; Hayashi, Takahiko; Miyoshi, Shiro; Bioorganic and Medicinal Chemistry Letters; vol. 24; nb. 5; (2014); p. 1327 - 1333, View in Reaxys

XVIII

Khalilova; Tagirov; Doronina; Spirikhin; Salikhov; Valeev; Russian Journal of Organic Chemistry; vol. 50; nb. 1; (2014); p. 110 - 116; Zh. Org. Khim.; vol. 50; nb. 1; (2014); p. 118 - 124,7, View in Reaxys

2q

Meng, Xu; Li, Xiaolong; Chen, Wenlin; Zhang, Yuanqing; Wang, Wen; Chen, Jinying; Song, Jinli; Feng, Huijie; Chen, Baohua; Journal of Heterocyclic Chemistry; vol. 51; nb. 2; (2014); p. 349 - 356, View in Reaxys

D

Wang, Jia; Zhu, Hai-Tao; Li, Ying-Xiu; Wang, Li-Jing; Qiu, Yi-Feng; Qiu, Zi-Hang; Zhong, Mei-Jin; Liu, Xue-Yuan; Liang, Yong-Min; Organic Letters; vol. 16; nb. 8; (2014); p. 2236 - 2239, View in Reaxys

7m

Xie, Aming; Zhou, Xiangxiang; Feng, Liandong; Hu, Xinyu; Dong, Wei; Tetrahedron; vol. 70; nb. 21; (2014); p. 3514 - 3519, View in Reaxys

7q

Liu, Chengwei; Qian, Qinqin; Nie, Kun; Wang, Yaorong; Shen, Qi; Yuan, Dan; Yao, Yingming; Dalton Transactions; vol. 43; nb. 22; (2014); p. 8355 - 8362, View in Reaxys

42

Jansone-Popova, Santa; Le, Phong Q.; May, Jeremy A.; Tetrahedron; vol. 70; nb. 27-28; (2014); p. 4118 4127, View in Reaxys

7l

Thorat, Prerana B.; Bhong, Bhagyashree Y.; Shelke, Amol V.; Karade, Nandkishor N.; Tetrahedron Letters; vol. 55; nb. 22; (2014); p. 3332 - 3335, View in Reaxys

1f

Tang, Shan; Wu, Xudong; Liao, Wenqing; Liu, Kun; Liu, Chao; Luo, Sanzhong; Lei, Aiwen; Organic Letters; vol. 16; nb. 13; (2014); p. 3584 - 3587, View in Reaxys

1{10}

Mobaraki, Akbar; Movassagh, Barahman; Karimi, Babak; ACS Combinatorial Science; vol. 16; nb. 7; (2014); p. 352 - 358, View in Reaxys

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1u'

Mo, Fanyang; Dong, Guangbin; Science; vol. 345; nb. 6192; (2014); p. 68 - 72, View in Reaxys

2, n=2

Cabrera, Armando; Sharma, Pankaj; Javier Perez-Flores; Velasco, Luis; Luis Arias; Rubio-Perez, Laura; Catalysis Science and Technology; vol. 4; nb. 8; (2014); p. 2626 - 2630, View in Reaxys

IIa

Sarasija, M.; Sudershan, K.; Ashok, D.; Shivaraj; Russian Journal of General Chemistry; vol. 84; nb. 8; (2014); p. 1622 - 1628; Zhurnal Obshchei Khimii; (2014), View in Reaxys; Stepanova; Maslivets; Russian Journal of Organic Chemistry; vol. 50; nb. 9; (2014); p. 1380 - 1381; Zh. Org. Khim.; vol. 50; nb. 9; (2014); p.

1394 - 1395, View in Reaxys

11d

Kamal, Ahmed; Sathish, Manda; Srinivasulu, Vunnam; Chetna, Jadala; Chandra Shekar, Kunta; Nekkanti, Shalini; Tangella, Yellaiah; Shankaraiah, Nagula; Organic and Biomolecular Chemistry; vol. 12; nb.

40; (2014); p. 8008 - 8018, View in Reaxys

3p

Gujar, Jitendra B.; Chaudhari, Mahendra A.; Kawade, Deepak S.; Shingare, Murlidhar S.; Tetrahedron Letters; vol. 55; nb. 44; (2014); p. 6030 - 6033, View in Reaxys

6f

Chen, Wenfang; Xie, Zhiyu; Zheng, Hongbo; Lou, Hongxiang; Liu, Lei; Organic Letters; vol. 16; nb. 22; (2014); p. 5988 - 5991, View in Reaxys

11b

Moles, Fernando J.N.; Ban-Caballero, Abraham; Guillena, Gabriela; Njera, Carmen; Tetrahedron Asymmetry; vol. 25; nb. 18-19; (2014); p. 1323 - 1330, View in Reaxys

4t

Liu, Chengwei; Zhang, Yu; Qian, Qinqin; Yuan, Dan; Yao, Yingming; Organic Letters; vol. 16; nb. 23; (2014); p. 6172 - 6175, View in Reaxys

I

Brinkevich; Reztsov; Shadyro; High Energy Chemistry; vol. 48; nb. 5; (2014); p. 303 - 309; Khim. Vys. Energ.; vol. 48; nb. 5; (2014); p. 350 - 357,8, View in Reaxys

1a'

Hwang, Kuo Chu; Sagadevan, Arunachalam; Science; vol. 346; nb. 6216; (2014); p. 1495 - 1498, View in Reaxys

12

Sudha; Sankararaman; Journal of the Chemical Society - Perkin Transactions 1; nb. 4; (1999); p. 383 - 386, View in Reaxys; Patent; BETHESDA PHARMACEUTICALS, INC.; WO2005/9437; (2005); (A1) English, View in Reaxys; Sinha, Mantosh K.; Khoury, Kareem; Herdtweck, Eberhardt; Dömling, Alexander; Organic and Biomolecular Chemistry; vol. 11; nb. 29; (2013); p. 4792 - 4796, View in Reaxys

G

Patent; FIRMENICH SA; SANTORO, Francesco; SAUDAN, Lionel; SAUDAN, Michel, Alfred, Joseph; SAUDAN, Sylvia, Joyeuse, Adelaide; WO2012/84810; (2012); (A1) English, View in Reaxys; Patent; FIRMENICH SA; Santoro, Francesco; Saudan, Lionel; Saudan, Christophe; US2013/274487; (2013); (A1) English, View in Reaxys

17b

Han, Xinping; Li, Hui; Hughes, Russell P.; Wu, Jimmy; Angewandte Chemie - International Edition; vol.

51; nb. 41; (2012); p. 10390 - 10393, View in Reaxys; Patent; TRUSTEES OF DARTMOUTH COLLEGE; WU, Jimmy; WO2013/177241; (2013); (A1) English, View in Reaxys

23

Li, Zining; Liang, Guangxin; Tetrahedron Letters; vol. 54; nb. 3; (2013); p. 242 - 244, View in Reaxys; Pichette, Simon; Winter, Dana K.; Lessard, Jean; Spino, Claude; Journal of Organic Chemistry; vol. 78; nb.

24; (2013); p. 12532 - 12544, View in Reaxys

1o

Fleury, Lauren M.; Kosal, Andrew D.; Masters, James T.; Ashfeld, Brandon L.; Journal of Organic Chemistry; vol. 78; nb. 2; (2013); p. 253 - 269, View in Reaxys

18

Glaszczka, Rafal; Jazwinski, Jaroslaw; Journal of Molecular Structure; vol. 1036; (2013); p. 78 - 89, View in Reaxys

3j

Paleta, Oldrich; Dolensky, Bohumil; Palecek, Jiri; Kvicala, Jaroslav; European Journal of Organic Chemistry; nb. 7; (2013); p. 1262 - 1270, View in Reaxys

2; 4

Safaei, Hamid Reza; Shekouhy, Mohsen; Shafiee, Vahid; Davoodi, Mansooreh; Journal of Molecular Liquids; vol. 180; (2013); p. 139 - 144, View in Reaxys

2bb

Nasseri; Alavi; Zakerinasab; Journal of Chemical Sciences; vol. 125; nb. 1; (2013); p. 109 - 116, View in Reaxys

24

Kuethe, Jeffrey T.; Maloney, Kevin M.; Tetrahedron; vol. 69; nb. 25; (2013); p. 5248 - 5258, View in Reaxys

1; CPO

Yang, Yanliang; Du, Zhongtian; Huang, Yizheng; Lu, Fang; Wang, Feng; Gao, Jin; Xu, Jie; Green Chemistry; vol. 15; nb. 7; (2013); p. 1932 - 1940, View in Reaxys

9f

Prakash, G. K. Surya; Paknia, Farzaneh; Narayan, Arjun; Mathew, Thomas; Olah, George A.; Journal of Fluorine Chemistry; vol. 152; (2013); p. 99 - 105, View in Reaxys

3i

Kamimura, Daigo; Urabe, Daisuke; Nagatomo, Masanori; Inoue, Masayuki; Organic Letters; vol. 15; nb.

19; (2013); p. 5122 - 5125, View in Reaxys

4c

Li, Longxia; Fang, Zhijie; Fang, Jie; Zhou, Jianguang; Xiang, Yanfei; RSC Advances; vol. 3; nb. 43; (2013); p. 21084 - 21091, View in Reaxys

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13

Zhang, Shuanming; Baldino, Salvatore; Baratta, Walter; Organometallics; vol. 32; nb. 19; (2013); p. 5299 - 5304, View in Reaxys

42-a

Patent; PHARMASCIENCE, INC.; LAURENT, Alain; ROSE, Yannick; JAQUITH, James B.; WO2013/177668; (2013); (A1) English, View in Reaxys

2n

Yadav; Subba Reddy; Reddy; Sabitha; Synlett; nb. 7; (2001); p. 1134 - 1136, View in Reaxys; Xie, Ruilong; Ling, Yun; Fu, Hua; Chemical Communications; vol. 48; nb. 100; (2012); p. 12210 - 12212, View in Reaxys

3h

Csjernyik, Gabor; Ell, Alida H.; Fadini, Luca; Pugin, Benoit; Baeckvall, Jan-E.; Journal of Organic Chemistry; vol. 67; nb. 5; (2002); p. 1657 - 1662, View in Reaxys; Ghorai, Manas K.; Halder, Sandipan; Samanta, Sauvik; Australian Journal of Chemistry; vol. 65; nb. 9; (2012); p. 1262 - 1270,9, View in Reaxys; Ghorai, Manas K.; Halder, Sandipan; Samanta, Sauvik; Australian Journal of Chemistry; vol. 65; nb. 9; (2012); p.

1262 - 1270, View in Reaxys

14e

Dinca, Emanuela; Hartmann, Philip; Smrcek, Jakub; Dix, Ina; Jones, Peter G.; Jahn, Ullrich; European Journal of Organic Chemistry; nb. 24; (2012); p. 4461 - 4482, View in Reaxys

2{4}

Khoury, Kareem; Sinha, Mantosh K.; Nagashima, Tadamichi; Doemling, Alexander; Herdtweck, Eberhardt; Angewandte Chemie, International Edition; vol. 51; nb. 41; (2012); p. 10280 - 10283,4; Angewandte Chemie; vol. 124; nb. 41; (2012); p. 10426 - 10429, View in Reaxys; Khoury, Kareem; Sinha, Mantosh K.; Nagashima, Tadamichi; Herdtweck, Eberhardt; Dömling, Alexander; Angewandte Chemie - International Edition; vol. 51; nb. 41; (2012); p. 10280 - 10283; Angewandte Chemie; vol. 124; nb. 41; (2012); p. 10426 10429, View in Reaxys

26

Agarwal, Jyoti; Peddinti, Rama Krishna; European Journal of Organic Chemistry; nb. 32; (2012); p. 6390 6406,17, View in Reaxys; Agarwal, Jyoti; Peddinti, Rama Krishna; European Journal of Organic Chemistry; nb. 32; (2012); p. 6390 - 6406, View in Reaxys

8g

Kawahara, Ryoko; Fujita, Ken-Ichi; Yamaguchi, Ryohei; Angewandte Chemie - International Edition; vol.

51; nb. 51; (2012); p. 12790 - 12794; Angew. Chem.; (2012); p. 12962 - 12966, View in Reaxys

9c

Kochetkov, Sergei V.; Kucherenko, Alexandr S.; Kryshtal, Galina V.; Zhdankina, Galina M.; Zlotin, Sergei G.; European Journal of Organic Chemistry; nb. 36; (2012); p. 7129 - 7134, View in Reaxys

a'

Tandon, Praveen K.; Singh, Santosh B.; Singh, Satpal; Kesarwani, Bhawana; Journal of the Indian Chemical Society; vol. 89; nb. 10; (2012); p. 1363 - 1367, View in Reaxys

62

Patent; BARBOSA, Joseph; CARSON, Kenneth Gordon; GARDYAN, Michael Walter; HEALY, Jason Patrick; HAN, Qiang; MABON, Ross; PABBA, Praveen; TARVER, JR., James; TERRANOVA, Kristen M.; TUNOORI, Ashok; XU, Xiaolian; US2012/302562; (2012); (A1) English, View in Reaxys

I-31

Patent; Chytil, Milan; Engel, Sharon R.; Fang, Qun Kevin; US2011/65694; (2011); (A1) English, View in Reaxys

XI

Patent; Chiral Quest, Inc.; US2011/257408; (2011); (A1) English, View in Reaxys

27; 39

Patent; The State of Oregon acting by and through the State Board of Higher Education on behalf of Orego; US2010/184986; (2010); (A1) English, View in Reaxys

III

Patent; ALEMBIC LIMITED; PONNAIAH, Ravi; DESAI, Sanjay; RATHOD, Dhiraj; PARIKH, Chirag; MOKAL, Ramesh; WO2010/79405; (2010); (A2) English, View in Reaxys

starting product 3

Patent; GALDERMA RESEARCH and DEVELOPMENT; WO2009/30747; (2009); (A1) English, View in Reaxys

Tab.1.run24

Wang, Feng; Ueda, Wataru; Chemistry Letters; vol. 37; nb. 2; (2008); p. 184 - 185, View in Reaxys

product, T-2, entry 2

Youm, Jennessa Ji Youn; Schlaf, Marcel; Bierenstiel, Matthias; Tetrahedron Letters; vol. 49; nb. 20; (2008); p. 3199 - 3203, View in Reaxys

B

Patent; CEPHALON, INC.; WO2008/63644; (2008); (A1) English, View in Reaxys

Table 3. A from e

Micoli, Francesca; Oberhauser, Werner; Salvini, Antonella; Bianchini, Claudio; Journal of Organometallic Chemistry; vol. 692; nb. 11; (2007); p. 2334 - 2341, View in Reaxys

Table 2. product 5 Luan, Yi; Wang, Ge; Luck, Rudy L.; Yang, Mu; Han, Xiao; Chemistry Letters; vol. 36; nb. 10; (2007); p.

1236 - 1237, View in Reaxys Compound 1a; A1; 1a

Patent; JANSSEN PHARMACEUTICA, N.V.; WO2007/35945; (2007); (A1) English, View in Reaxys

product, entry 10

Joseph, Jomy K.; Jain, Suman L.; Sain, Bir; European Journal of Organic Chemistry; nb. 3; (2006); p. 590 - 594, View in Reaxys

Tab.2. col.6. run 7 Miyazawa, Akira; Saitou, Kaori; Tanaka, Kan; Gaedda, Thomas M.; Tashiro, Masashi; Prakash, G. K. Surya; Olah, George A.; Tetrahedron Letters; vol. 47; nb. 9; (2006); p. 1437 - 1439, View in Reaxys

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2017-10-12 21:31:24

product, row 1

Maiti, Swarup K.; Dinda, Subhajit; Gharah, Narottam; Bhattacharyya, Ramgopal; New Journal of Chemistry; vol. 30; nb. 3; (2006); p. 479 - 489, View in Reaxys

Product, Tab.2, run 1

Huang, Jian-Ying; Li, Shi-Jun; Wang, Yan-Guang; Tetrahedron Letters; vol. 47; nb. 32; (2006); p. 5637 5640, View in Reaxys

Table 1, entry 7

Jain, Suman L.; Sharma, Vishal B.; Sain, Bir; Bulletin of the Chemical Society of Japan; vol. 79; nb. 10; (2006); p. 1601 - 1603, View in Reaxys

Tab.1.col.3. run 1. Han, Jung Hee; Yoo, Sang-Kun; Seo, Jin Soo; Hong, Sung Jin; Kim, Seok Kyu; Kim, Cheal; Dalton Transactions; nb. 2; (2005); p. 402 - 406, View in Reaxys Tab. 2, entry 1

Starokon; Dubkov; Babushkin; Parmon; Panov; Advanced Synthesis and Catalysis; vol. 346; nb. 2-3; (2004); p. 268 - 274, View in Reaxys

Tab.1.col.3.run 4

Martin, Sandra E.; Garrone, Analia; Tetrahedron Letters; vol. 44; nb. 3; (2003); p. 549 - 552, View in Reaxys

Product, Tab.1, run 3

Lee, Hee-Yoon; An, Mihyun; Tetrahedron Letters; vol. 44; nb. 14; (2003); p. 2775 - 2778, View in Reaxys

Tab.1, entry 9

Sharma, Vishal B.; Jain, Suman L.; Sain, Bir; Tetrahedron Letters; vol. 44; nb. 2; (2003); p. 383 - 386, View in Reaxys

Product, Tab. 1,run 7/20

Shirini; Zolfigol; Safari; Mohammadpoor-Baltork; Mirjalili; Tetrahedron Letters; vol. 44; nb. 40; (2003); p.

7463 - 7465, View in Reaxys

prod., Tab. 2, entry 18

Yamaguchi, Kazuya; Mizuno, Noritaka; Chemistry - A European Journal; vol. 9; nb. 18; (2003); p. 4353 4361, View in Reaxys

Product, Tab.3, run 3

Fujita, Ken-Ichi; Furukawa, Shigetoyo; Yamaguchi, Ryohei; Journal of Organometalic Chemistry; vol.

649; nb. 2; (2002); p. 289 - 292, View in Reaxys

tab1, run3, ketone El-Qisairi, Arab K; Qaseer, Hanan A; Journal of Organometallic Chemistry; vol. 659; nb. 1-2; (2002); p. 50 55, View in Reaxys Table 2, col 4, en- Leshchev; Russian Journal of Physical Chemistry A; vol. 76; nb. 10; (2002); p. 1597 - 1603, View in Reaxys try 3 4a (carbonyl)

De Lijser, H. J. Peter; Fardoun, Fadia H.; Sawyer, Jody R.; Quant, Michelle; Organic Letters; vol. 4; nb.

14; (2002); p. 2325 - 2328, View in Reaxys

table 2, substrate 2

Shulman, Avidor; Sitry, Danielle; Shulman, Hagit; Keinan, Ehud; Chemistry - A European Journal; vol. 8; nb. 1; (2002); p. 229 - 239, View in Reaxys

c-C4H8CO

Bernazzani, Luca; Ceccanti, Norberto; Conti, Giovanni; Gianni, Paolo; Mollica, Vincenzo; Rosaria Tine, Maria; Lepori, Luciano; Matteoli, Enrico; Spanedda, Andrea; Journal of Chemical Thermodynamics; vol. 33; nb. 6; (2001); p. 629 - 641, View in Reaxys

5j

Hajipour; Mallakpour; Mohammadpoor-Baltork; Khoee; Synthetic Communications; vol. 31; nb. 8; (2001); p. 1187 - 1194, View in Reaxys

9a (tab VI)

Hajipour; Mallakpour; Molecular Crystals and Liquid Crystals Science and Technology, Section A: Molecular Crystals and Liquid Crystals; vol. 356; (2001); p. 371 - 387, View in Reaxys

t.1,product,entry 7 Ghiaci; Asghari; Synthetic Communications; vol. 30; nb. 21; (2000); p. 3865 - 3872, View in Reaxys 2h (product)

Bandgar; Makone; Organic Preparations and Procedures International; vol. 32; nb. 4; (2000); p. 391 - 394, View in Reaxys

c-C5H10

Orlando, John J.; Iraci, Laura T.; Tyndall, Geoffrey S.; Journal of Physical Chemistry A; vol. 104; nb. 21; (2000); p. 5072 - 5079, View in Reaxys

R1COR2, R1,R2=-(CH2)4-

Katritzky; Bao; Fang; Qi; Prakash; Tetrahedron Letters; vol. 40; nb. 2; (1999); p. 253 - 256, View in Reaxys

(CH2)4CO

Foubelo, Francisco; Gutierrez, Ana; Yus, Miguel; Synthesis; nb. 3; (1999); p. 503 - 514, View in Reaxys

Tab.2. ketone run 5

Machrouhi, Fouzia; Namy, Jean-Louis; Tetrahedron Letters; vol. 40; nb. 7; (1999); p. 1315 - 1318, View in Reaxys

educt to 105

Reggelin, Michael; Gerlach, Matthias; Vogt, Melanie; European Journal of Organic Chemistry; nb. 5; (1999); p. 1011 - 1031, View in Reaxys

cyclopentanone

Kisanga, Philip B.; Verkade, John G.; Journal of Organic Chemistry; vol. 64; nb. 12; (1999); p. 4298 - 4303, View in Reaxys

P

Al-Qallaf, Fawzia A. H.; Johnstone, Robert A. W.; Liu, Jun-Yao; Lu, Ling; Whittaker, David; Journal of the Chemical Society. Perkin Transactions 2; nb. 7; (1999); p. 1421 - 1423, View in Reaxys

Copyright © 2017 Reed Elsevier Properties SA. All rights reserved. Authorized use only. Reaxys® and the Reaxys® trademark are owned and protected by Reed Elsevier Properties SA and used under license.

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2017-10-12 21:31:24

3a (Tab. 2)

Hajipour, Abdol Reza; Mohammadpoor-Baltork, Iraj; Niknam, Kurosh; Organic Preparations and Procedures International; vol. 31; nb. 3; (1999); p. 335 - 341, View in Reaxys

Tab.1. col.1 run 4. Si-Fodil, Mohamed; Ferreira, Humberto; Gralak, Jean; Duhamel, Lucette; Tetrahedron Letters; vol. 39; nb. 49; (1998); p. 8975 - 8978, View in Reaxys 8a

Pandey, Ganesh; Ghorai, Manas K.; Hajra, Saumen; Tetrahedron Letters; vol. 39; nb. 45; (1998); p. 8341 8344, View in Reaxys

2c/2m

Zhang, Gui-Sheng; Yang, De-Hong; Chen, Mi-Feng; Organic Preparations and Procedures International; vol. 30; nb. 6; (1998); p. 713 - 716, View in Reaxys

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Patent; Sumitomo Chemical Company, Limited; EP1188735; (2002); (A1) English, View in Reaxys Patent; Colorado State University Research Foundation; US6369245; (2002); (B1) English, View in Reaxys Patent; Daicel Chemical Industries, Ltd.; EP1178031; (2002); (A1) English, View in Reaxys

Druglikeness (1) 1 of 1

LogP

0.351

H Bond Donors

0

H Bond Acceptors

1

Rotatable Bonds

0

TPSA

17.07

Lipinski Number

4

Veber Number

2

Related Structure (3) Related Structure Referenced Com- References pound The following tau- epoxycyclopentomers are distene cussed: /BRN= 3600657/

Meenakshisundaram; Sockalingam; Bulletin of the Chemical Society of Japan; vol. 74; nb. 6; (2001); p. 1043 - 1049, View in Reaxys; El-Qisairi, Arab K; Qaseer, Hanan A; Journal of Organometallic Chemistry; vol. 659; nb. 1-2; (2002); p. 50 - 55, View in Reaxys

The author inves- epoxycyclopentigated the consti- tene tution. The following tautomers are discussed: /BRN= 3600657/

Toullec, par Jean; Tetrahedron Letters; vol. 25; nb. 39; (1984); p. 4401 - 4402, View in Reaxys

Hine; Arata; Bulletin of the Chemical Society of Japan; vol. 49; (1976); p. 3089, View in Reaxys; Seamans et al.; Journal of the American Chemical Society; vol. 94; (1972); p. 6464,6472,6473, View in Reaxys Derivative (56) Comment (Derivative)

Derivative

References

cyclopentanone 2,4-dinitrophenylhydrazone

Shaabani; Ajabi; Indian Journal of Chemistry - Section B Organic and Medicinal Chemistry; vol. 40; nb. 2; (2001); p. 148 - 151, View in Reaxys

cyclopentanone 2,4-dinitrophenylhydrazone

Yoneda, Fumio; Mori, Kenya; Sakuma, Yoshiharu; Koshiro, Akira; Journal of Heterocyclic Chemistry; vol. 19; (1982); p. 945 - 947, View in Reaxys; Ogura, K.; Yamashita, M.; Suzuki, M.; Furukawa, S.; Tsuchinashi, G.; Bulletin of the Chemical Society of Ja-

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pan; vol. 57; nb. 6; (1984); p. 1637 - 1642, View in Reaxys; Ohta, Hiromichi; Fujiwara, Hidenori; Tsuchihashi, Gen-ichi; Agricultural and Biological Chemistry; vol. 48; nb. 2; (1984); p. 317 - 322, View in Reaxys; Chambers, Richard D.; Hutchinson, John; Sandford, Graham; Shah, Aneela; Vaughan, Julian F. S.; Tetrahedron; vol. 53; nb. 46; (1997); p. 15833 - 15842, View in Reaxys By formation of salt/complex with 2,4-dinitrophenylhydrazine. Melting point at: 145 C - 146 C

'Femi-Onadeko, Bankole; Acta Chimica Hungarica; vol. 122; nb. 2; (1986); p. 175 - 180, View in Reaxys

2,4-Dinitrophenylhydrazon: F: 143.7grad

Olah et al.; Synthesis; (1979); p. 274, View in Reaxys

Komplexe mit Naphthol-2 und Tetracyanoethylen: Komplexbildungskonstanten, UV(Tab.)

Kraus et al.; Comptes Rendus des Seances de l'Academie des Sciences, Serie C: Sciences Chimiques; vol. 288; (1979); p. 9,10, View in Reaxys

2,4-DNP: F=144-145grad

Omura,K.; Swern,D.; Tetrahedron; vol. 34; (1978); p. 1651 - 1660, View in Reaxys

Li-Enolat: aus Keton u. LiNH2; IR

Lochmann et al.; Journal of Organometallic Chemistry; vol. 156; (1978); p. 307,308,312, View in Reaxys

Komplex mit C6F6: 19F-NMR, k-Werte

Muller; Journal of Magnetic Resonance (1969-1992); vol. 25; (1977); p. 111,118, View in Reaxys

Komplex mit CBr2F2: 19FNMR, k-Werte

Muller; Journal of Magnetic Resonance (1969-1992); vol. 25; (1977); p. 111,118, View in Reaxys

2,4-Dinitrophenylhydrazon: F: 147grad

Ogibin; Troyanskii; Nikishin; Bulletin of the Academy of Sciences of the USSR Division of Chemical Science; vol. 26; nb. 4; (1977); p. 767 - 771, View in Reaxys

Komplex m. Phenol: Polarisation (Tab. 1, Fig. 1); μ, K (Tab. 2); ε (Fig. 2); μ, ΔG (Tab. 3)

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258; (1977); p. 673, View in Reaxys

2,4-DNP: F: 142-143grad

Kuehne; Hall; Journal of Organic Chemistry; vol. 41; (1976); p. 2742, View in Reaxys

Komplex mit pChlorophenol: IR; 1H-NMR; K(ass)

Buzzi,B.T. et al.; Journal of the Chemical Society, Perkin Transactions 2: Physical Organic Chemistry (1972-1999); (1975); p. 1294 - 1298, View in Reaxys

Charge-TransferKomplex m. Carbonylcyanid: UV (Fig.2)

Kociolek,K.; Leplawy,M.; Roczniki Chemii; vol. 49; (1975); p. 1841 - 1851, View in Reaxys

BF3-Addukt: NMR (Fig.1)(Fig. 2); syn-anti-Austausch (NMR): Fig.1, Tab.1; ΔG(excit.) (Tab.1)

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Dinitrophenylhydrazon: F: 142grad

Rabiller,C. et al.; Bulletin de la Societe Chimique de France; (1974); p. 3055 - 3058, View in Reaxys

BF3-Komplex: Faradayeffekt

Castan et al.; Journal de Chimie Physique et de Physico-Chimie Biologique; vol. 70; (1973); p. 1162, View in Reaxys

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BF3-Komplex: 1H- u. 19F-NMR (s.Tab.I)

Fratiello et al.; Journal of Organic Chemistry; vol. 38; (1973); p. 2309,2310, View in Reaxys

2,4-Dinitrophenylhydrazon: F: 142-144grad, gelb

Odinokov et al.; Zhurnal Organicheskoi Khimii; vol. 9; (1973); p. 671,691, View in Reaxys

BF3 - Komplex: IR ( C=O) Tabl.

Pagliardini et al.; Tetrahedron Letters; (1972); p. 4241,4242, View in Reaxys

2,4-DNP-Derivat.

F: 145.6-146.2grad

Hermes,M.E.; Marsh,F.D.; Journal of Organic Chemistry; vol. 37; nb. 19; (1972); p. 2969 - 2979, View in Reaxys

BF3-Komplex: aus den Komponenten; UV (Tab. I)

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2.4-Dinitrophenylhydrazon: F: 141-143grad, gelb

Scanlan; MacKenzie; Journal of Organic Chemistry; vol. 37; (1972); p. 1579,1581, View in Reaxys

Komplex m. Pyrrol: Molpolarisation, Dipolmoment

Castagna et al.; Annales de Chimie (Cachan, France); vol. 7; nb. 14; (1972); p. 5,14, View in Reaxys

BF3-Addukt: NMR

Torri et al.; Bulletin de la Societe Chimique de France; (1970); p. 2167, View in Reaxys

Komplexbildung mit SO2, Kraftskonstante

Winde; Zeitschrift fuer Physikalische Chemie (Leipzig); vol. 245; (1970); p. 401, View in Reaxys

Semicarbazon: F: 207grad

Nakai et al.; Bulletin of the Chemical Society of Japan; vol. 42; (1969); p. 2917,2918, View in Reaxys

Komplex mit Benzol: Kerr-Konst.

Le Fevre et al.; Journal of the Chemical Society [Section] B: Physical Organic; (1968); p.

148, View in Reaxys

H-Brueckenbind.mit Pyrrol (Konfig., Bldg.Konst.)

Giavarini; Gomel; Comptes Rendus des Seances de l'Academie des Sciences, Serie C: Sciences Chimiques; vol. 267; (1968); p. 1, View in Reaxys

1:1-Komplex mit 1,1,4,4-Tetraphenyl-butin-(2)diol-(1,4): Bldg.

Toda; Akagi; Tetrahedron Letters; (1968); p. 3695, View in Reaxys

1:1-Komplex mit 1,1,6,6-Tetraphenyl-hexadiin(2,4)-diol-(1,6): Bldg.

Toda; Akagi; Tetrahedron Letters; (1968); p. 3695, View in Reaxys

Phenylhydrazon: F: 49-50grad

Kanaoka,Y. et al.; Chemical and Pharmaceutical Bulletin; vol. 14; (1966); p. 934 - 939, View in Reaxys

2,4-Dinitro-phenylhydrazon; F: 144-146grad (unkorr.)

Harrison et al.; Journal of Organic Chemistry; vol. 31; (1966); p. 1294,1295, View in Reaxys

Komplex mit Iod: C5H8O*I2: Stabilitaetskonstante <Cyclohexan, 25grad>; Bildungsenthalpie

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Gleichgew.konst. des Komplexes

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mit p-Xylol in nHexan bei 25grad (spektroskop.ermittelt) Iod-Komplex: λ(max); K; ΔF, ΔH, ΔS

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3559,3561, View in Reaxys

2,6-Dinitro-4methyl-phenylhydrazon (F: 120grad)

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Addukt mit Decachlor-octahydro-1.3.4-metheno-2H-cyclobuta<cd>pentalenon-(2): F: 195-197grad; IR

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5-Nitro-thiazol-2yl-hydrazon. F: 222grad

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<5-Nitro-thiazol-2yl>-hydrazon: Zers.: 222grad

Graner; Revista de la Real Academia de Ciencias Exactas, Fisicas y Naturales de Madrid; vol. 56; (1962); p. 623,702; Chem.Abstr.; vol. 59; nb. 1614; (1963), View in Reaxys

Farbreaktion und colorimetr.Bestg. mittels Oxalsaeuredihydrazid und Kupferacetat in W.

BARTOS; BURTIN; Annales pharmaceutiques françaises; vol. 19; (1961); p. 769 - 770, View in Reaxys

Bestimmung im Gemisch mit Cyclohexanon aufgrund der verschieden schnellen Rk. mit NH2OH.HCl in wss.Me.

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Bestimmung im Gemisch mit Pentanon-(3) aufgrund der verschieden schnellen Rk. mit NH2OH.HCl in wss.Me.

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2,4-Dinitrophenylhydrazon; F: 144-145grad

Heyns; Blazejewicz; Tetrahedron; vol. 9; (1960); p. 67,73, View in Reaxys

4-carboxy-phenylhydrazone (mp: 250-251 degree )

Veibel; Acta Chemica Scandinavica (1947-1973); vol. 1; (1947); p. 54,63, View in Reaxys; Veibel; Blaaberg; Stevens; Dansk Tidsskrift for Farmaci; vol. 14; (1940); p. 188; Chem.Abstr.; (1942); p. 2495, View in Reaxys

3.5-dinitro-4methyl-benzoylhydrazone (mp: 176 degree )

Sah; Journal of the Chinese Chemical Society (Peking); vol. 14; (1946); p. 45,48, View in Reaxys

semicarbazone (mp: 204 degree )

Mannich; Chemische Berichte; vol. 74; (1941); p. 565,568, View in Reaxys

1-methyl-3-cyclopentylidenehydrazinocarbonyl-pyridinium-<toluene

Allen; Gates; Journal of Organic Chemistry; vol. 6; (1941); p. 596,599, View in Reaxys

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sulfonate-(4) (mp: 181 degree ) semicarbazone (mp: 205 degree )

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2-bromo-benzoylhydrazone (mp: 160-161 degree )

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oxime (mp: 57 degree )

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semicarbazone (mp: 205-206 degree )

Ramart-Lucas; Hoch; Bulletin de la Societe Chimique de France; vol. <5> 2; (1935); p.

327,333; Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences; vol. 201; (1935); p. 1387, View in Reaxys

3-nitro-benzoylhydrazone (mp: 148,5-149,5 degree )

Strain; Journal of the American Chemical Society; vol. 57; (1935); p. 758,760; Journal of Biological Chemistry; vol. 102; (1933); p. 137,142, View in Reaxys

2.4-dinitro-phenylhydrazone (mp: 145,5-146,5 degree )

Strain; Journal of the American Chemical Society; vol. 57; (1935); p. 758,760; Journal of Biological Chemistry; vol. 102; (1933); p. 137,142, View in Reaxys

4-bromo-phenylhydrazone (mp: 109 degree )

Plant; Tomlinson; Journal of the Chemical Society; (1931); p. 3324,3330,; Journal of the Chemical Society; (1933); p. 298,299, View in Reaxys

2.4-dinitro-phenylhydrazone (mp: 142 degree )

Allen; Journal of the American Chemical Society; vol. 52; (1930); p. 2956; Organic Syntheses; vol. Coll. Vol. II; (1943); p. 228, View in Reaxys

Purification (1) References Harrison et al.; Journal of Organic Chemistry; vol. 31; (1966); p. 1294,1295, View in Reaxys; Allen et al.; Journal of the Chemical Society; (1960); p. 1909,1911, View in Reaxys Melting Point (8) 1 of 8

Melting Point [°C]

-51.91

Guanquan, Che; Ott, J. Bevan; Goates, J. Rex; Journal of Chemical Thermodynamics; vol. 18; nb. 4; (1986); p.

323 - 330, View in Reaxys 2 of 8

Melting Point [°C]

-53.1

Sellers; Sunner; Acta Chemica Scandinavica (1947-1973); vol. 16; (1962); p. 46,51, View in Reaxys 3 of 8

Solvent (Melting Point)

acetone

Labruyere-Verhavert; Bulletin des Societes Chimiques Belges; vol. 60; (1951); p. 270,274, View in Reaxys 4 of 8

Solvent (Melting Point)

pentan-2-one

Labruyere-Verhavert; Bulletin des Societes Chimiques Belges; vol. 60; (1951); p. 270,274, View in Reaxys 5 of 8

Melting Point [°C]

-51

White; Bishop; Journal of the American Chemical Society; vol. 62; (1940); p. 8,10, View in Reaxys 6 of 8

Melting Point [°C]

-51.6

Conn; Kistiakowsky; Smith; Journal of the American Chemical Society; vol. 61; (1939); p. 1868,1869, View in Reaxys 7 of 8

Melting Point [°C]

-51.3

Timmermans; Hennaut-Roland; Journal de Chimie Physique et de Physico-Chimie Biologique; vol. 34; (1937); p.

711; Chem. Zentralbl.; vol. 109; nb. II; (1938); p. 517, View in Reaxys 8 of 8

Melting Point [°C]

-52.8

Timmermans; Bulletin des Societes Chimiques Belges; vol. 36; (1927); p. 507; Chem. Zentralbl.; vol. 99; nb. I; (1928); p. 27, View in Reaxys

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25/119

2017-10-12 21:31:24

Boiling Point (60) Boiling Point [°C] Pressure (Boiling Point) [Torr] 130

Location

Comment (Boiling References Point)

supporting information

Liu, Lianghui; Yu, Mengmeng; Wayland, Bradford B.; Fu, Xuefeng; Chemical Communications; vol. 46; nb. 34; (2010); p. 6353 - 6355, View in Reaxys

126 - 129

Khazaei, Ardeshir; Sadri, Minoo; Hosseini, Hassan; Journal of the Chinese Chemical Society; vol. 54; nb. 4; (2007); p. 1011 - 1015, View in Reaxys

127 - 130

760

Hajipour; Mohammadpoor-Baltork; Kianfar; Indian Journal of Chemistry - Section B Organic and Medicinal Chemistry; vol. 38; nb. 2; (1999); p. 221 - 224, View in Reaxys; Hajipour; Mallakpour; Molecular Crystals and Liquid Crystals Science and Technology, Section A: Molecular Crystals and Liquid Crystals; vol. 356; (2001); p. 371 - 387, View in Reaxys

127 - 139

760

Shaabani; Karimi; Synthetic Communications; vol. 31; nb. 5; (2001); p. 759 - 765, View in Reaxys; Shaabani; Ajabi; Indian Journal of Chemistry - Section B Organic and Medicinal Chemistry; vol. 40; nb. 2; (2001); p. 148 - 151, View in Reaxys

27 - 28

12

Yu, Yongping; Zhang, Yongmin; Synthetic Communications; vol. 29; nb. 2; (1999); p. 243 247, View in Reaxys

128 - 132.5

Sato, Kazuhiko; Aoki, Masao; Takagi, Junko; Zimmermann, Klaus; Noyori, Ryoji; Bulletin of the Chemical Society of Japan; vol. 72; nb. 10; (1999); p. 2287 - 2306, View in Reaxys

129

759.8

Zhang, Gui-Sheng; Shi, Qi-Zeng; Chen, MiFeng; Cai, Kun; Synthetic Communications; vol.

27; nb. 21; (1997); p. 3691 - 3696, View in Reaxys

73 - 77

25

Shipov, A. G.; Kramarova, E. P.; Artamkina, O. B.; Oleneva, G. I.; Nepomnyashchaya, N. A.; Baukov, Yu. I.; Russian Journal of General Chemistry; vol. 65; nb. 2.2; (1995); p. 233 - 240; Zhurnal Obshchei Khimii; vol. 65; nb. 2; (1995); p. 272 - 280, View in Reaxys

130.73

Katunina, E. P.; Marchenko, I. M.; Chervova, O. V.; Polyakova, L. V.; Garber, Yu. N.; J. Appl.

Chem. USSR (Engl. Transl.); vol. 65; nb. 9.1; (1992); p. 2028 - 2033,1653 - 1657, View in Reaxys

30.28

15.001

Ambrose, D.; Ghiassee, N. B.; Journal of Chemical Thermodynamics; vol. 19; nb. 9; (1987); p. 903 - 910, View in Reaxys

130.57

760

Ambrose, D.; Ghiassee, N. B.; Journal of Chemical Thermodynamics; vol. 19; nb. 9; (1987); p. 903 - 910, View in Reaxys

128

760

Mandal, Arun K.; Shrotri, P. Y.; Ghogare, A. D.; Synthesis; nb. 3; (1986); p. 221 - 222, View in Reaxys

131

Copyright © 2017 Reed Elsevier Properties SA. All rights reserved. Authorized use only. Reaxys® and the Reaxys® trademark are owned and protected by Reed Elsevier Properties SA and used under license.

Vinogradov, M. G.; Tuzikov, A. B.; Nikishin, G. I.; Bulletin of the Academy of Sciences of the USSR, Division of Chemical Science (English Translation); vol. 34; nb. 2; (1985); p. 325 - 329; Izvestiya Akademii Nauk SSSR, Seriya Khimi-

26/119

2017-10-12 21:31:24

cheskaya; nb. 2; (1985); p. 356 - 361, View in Reaxys 130 - 131

Ogibin; Troyanskii; Nikishin; Bulletin of the Academy of Sciences of the USSR Division of Chemical Science; vol. 26; nb. 4; (1977); p. 767 771, View in Reaxys; Mechtiew et al.; Azerbaidzhanskii Khimicheskii Zhurnal; vol. 4; (1973); p. 29,35; Chem.Abstr.; vol. 80; nb. 132868; (1974), View in Reaxys; Mechtiew et al.; Azerbaidzhanskii Khimicheskii Zhurnal; vol. 1; (1973); p. 47; Chem.Abstr.; vol. 80; nb. 59537; (1974), View in Reaxys; Guth, Jacob J.; Gross, Rosalind L.; Carson, Frederick W.; Journal of Organic Chemistry; vol. 47; nb. 13; (1982); p. 2666 2668, View in Reaxys

126 - 130

760

Olah, George A.; Narang, Subbash C.; Mehrotra, Ashok K.; Synthesis; nb. 11; (1982); p. 965 966, View in Reaxys

85

200

Larock,R.C.; Oertle,K.; Potter,G.F.; Journal of the American Chemical Society; vol. 102; (1980); p. 190, View in Reaxys

70 - 72

131

Flatt et al.; Synthesis; (1979); p. 815, View in Reaxys

128 - 129

Fujihara et al.; Yukagaku; vol. 24; (1975); p.

654,657; Chem.Abstr.; vol. 84; nb. 59755n, View in Reaxys; Olah et al.; Synthesis; (1979); p.

113, View in Reaxys

129

760

Schwall,H. et al.; Chemische Berichte; vol. 102; nb. 5; (1969); p. 1731 - 1738, View in Reaxys; Olah et al.; Synthesis; (1979); p. 274, View in Reaxys

61

24

Huet,F. et al.; Synthesis; (1978); p. 63 - 65, View in Reaxys

128 - 129

760

Maloney; Lyle; Saavedra; Synthesis; vol. No. 3; (1978); p. 212 - 213, View in Reaxys

130 - 131

760

Huet,F. et al.; Synthesis; (1978); p. 63 - 65, View in Reaxys

130.6

Rao; Naidu; Journal of Chemical Thermodynamics; vol. 8; (1976); p. 73,74, 75, View in Reaxys

130.55

Meyer; Holz; Journal of Chemical and Engineering Data; vol. 21; (1976); p. 274,275-278, View in Reaxys

130

760

Franzen,V.; Otto,S.; Chemische Berichte; vol.

94; (1961); p. 1360 - 1363, View in Reaxys; Boldrini et al.; Synthesis; (1976); p. 596, View in Reaxys

129

Noller; Adams; Journal of the American Chemical Society; vol. 48; (1926); p. 1087, View in Reaxys; Dalton; Snyder; Journal of the American Chemical Society; vol. 97; (1975); p.

5192,5193 - 5194, View in Reaxys; Mhala; Singh; Journal of the Indian Chemical Society; vol. 52; (1975); p. 1092, View in Reaxys

133.8

Chen; Chen; Journal of the Chinese Chemical Society (Taipei, Taiwan); vol. 22; (1975); p. 279, View in Reaxys

129.5

760

de Botton,M.; Bulletin de la Societe Chimique de France; (1975); p. 1773 - 1776, View in Reaxys

130

Copyright © 2017 Reed Elsevier Properties SA. All rights reserved. Authorized use only. Reaxys® and the Reaxys® trademark are owned and protected by Reed Elsevier Properties SA and used under license.

Patent; Deutsche Advance Prod.; BE615018; (1962); DE; Chem.Abstr.; vol. 57; nb. 14941;

27/119

2017-10-12 21:31:24

(1962), View in Reaxys; Jaworski; Kwiatkowski; Roczniki Chemii; vol. 48; (1974); p. 263,268, View in Reaxys 40

15

Jaworski; Kwiatkowski; Roczniki Chemii; vol.

48; (1974); p. 263,268, View in Reaxys

126

760

Rabiller,C. et al.; Bulletin de la Societe Chimique de France; (1974); p. 3055 - 3058, View in Reaxys

34

12

Rollin; Bulletin de la Societe Chimique de France; (1973); p. 1509,1514, View in Reaxys

130.7

Wolf; Helvetica Chimica Acta; vol. 55; (1972); p.

1446, View in Reaxys

128 - 130

748

Liberman et al.; Bulletin of the Academy of Sciences of the USSR, Division of Chemical Science (English Translation); vol. 21; (1972); p.

1942; Izvestiya Akademii Nauk SSSR, Seriya Khimicheskaya; vol. 21; (1972); p. 2001, View in Reaxys

128 - 130.5

751

Liberman et al.; Bulletin of the Academy of Sciences of the USSR, Division of Chemical Science (English Translation); vol. 21; (1972); p.

1942; Izvestiya Akademii Nauk SSSR, Seriya Khimicheskaya; vol. 21; (1972); p. 2001, View in Reaxys

128 - 130

129 - 129.5

Liberman et al.; Bulletin of the Academy of Sciences of the USSR, Division of Chemical Science (English Translation); vol. 20; (1971); p.

1809,1811; Izvestiya Akademii Nauk SSSR, Seriya Khimicheskaya; vol. 20; (1971); p. 1917, View in Reaxys 760

de Botton; Comptes Rendus des Seances de l'Academie des Sciences, Serie C: Sciences Chimiques; vol. 272; (1971); p. 118, View in Reaxys

129 - 131

Mowsumsade et al.; Azerbaidzhanskii Khimicheskii Zhurnal; vol. 6; (1969); p. 86,88; Chem.Abstr.; vol. 74; nb. 53112; (1971), View in Reaxys

127 - 131

Maio; Tardella; Gazzetta Chimica Italiana; vol.

96; (1966); p. 526, View in Reaxys

129.5

Bell,J.M. et al.; Journal of Organic Chemistry; vol. 30; (1965); p. 4284 - 4292, View in Reaxys

130 - 130.7

Grove; Walden; Journal of Chemical and Engineering Data; vol. 10; (1965); p. 98, View in Reaxys

130.7

1

Sellers; Sunner; Acta Chemica Scandinavica (1947-1973); vol. 16; (1962); p. 46,51, View in Reaxys

128

Kosower; Wu; Journal of the American Chemical Society; vol. 83; (1961); p. 3146, View in Reaxys

130 - 130.5

Hentzschel; Wislicenus,J.; Justus Liebigs Annalen der Chemie; vol. 275; (1893); p. 313, View in Reaxys; Allen et al.; Journal of the Chemical Society; (1960); p. 1909,1911, View in Reaxys

143 - 147

Allen et al.; Journal of the Chemical Society; (1960); p. 1909,1911, View in Reaxys

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28/119

2017-10-12 21:31:24

129.5

744.5

Kobe et al.; Industrial and Engineering Chemistry; vol. 47; (1955); p. 1767,1771, View in Reaxys

130.7 - 130.8

765

Goheen; Journal of the American Chemical Society; vol. 63; (1941); p. 744,747, View in Reaxys

131.15

774

Conn; Kistiakowsky; Smith; Journal of the American Chemical Society; vol. 61; (1939); p.

1868,1869, View in Reaxys

129

756

Vogel; Journal of the Chemical Society; (1938); p. 1323,1328, View in Reaxys

130.7

760

Timmermans; Hennaut-Roland; Journal de Chimie Physique et de Physico-Chimie Biologique; vol. 34; (1937); p. 711; Chem. Zentralbl.; vol.

109; nb. II; (1938); p. 517, View in Reaxys

130.2 - 130.3

756

Dolliver et al.; Journal of the American Chemical Society; vol. 59; (1937); p. 831,832, View in Reaxys

130

720

Ruzicka; Giacomello; Helvetica Chimica Acta; vol. 20; (1937); p. 548,555, View in Reaxys

127.7

715

Mohler; Lohr; Helvetica Chimica Acta; vol. 20; (1937); p. 1183,1185, View in Reaxys

129.5

761.5

Vogel; Journal of the Chemical Society; (1928); p. 2025, View in Reaxys

23.2 - 23.6

10

v. Auwers; Hinterseber; Treppmann; Justus Liebigs Annalen der Chemie; vol. 410; (1915); p.

267, View in Reaxys

130 - 130.4

v. Auwers; Hinterseber; Treppmann; Justus Liebigs Annalen der Chemie; vol. 410; (1915); p.

267, View in Reaxys

31 - 32

12

Harries; Wagner; Justus Liebigs Annalen der Chemie; vol. 410; (1915); p. 39, View in Reaxys

37 - 38

17

Harries; Wagner; Justus Liebigs Annalen der Chemie; vol. 410; (1915); p. 39, View in Reaxys

129 - 129.5

754

Aschan; Chemische Berichte; vol. 45; (1912); p.

1605; Justus Liebigs Annalen der Chemie; vol.

383; (1911); p. 58, View in Reaxys

129

Oel.

Wallach; Justus Liebigs Annalen der Chemie; vol. 353; (1907); p. 325; Chem. Zentralbl.; vol.

78; nb. II; (1907); p. 55, View in Reaxys

Refractive Index (31) Refractive Index Wavelength (Refractive Index) [nm]

Temperature (Refractive Index) [°C]

References

1.43471

589

24.99

Dragoescu, Dana; Journal of Molecular Liquids; vol. 209; (2015); p.

713 - 722; Art.No: 4930, View in Reaxys

1.439

589

20

Shipov, A. G.; Kramarova, E. P.; Artamkina, O. B.; Oleneva, G. I.; Nepomnyashchaya, N. A.; Baukov, Yu. I.; Russian Journal of General Chemistry; vol. 65; nb. 2.2; (1995); p. 233 - 240; Zhurnal Obshchei Khimii; vol. 65; nb. 2; (1995); p. 272 - 280, View in Reaxys

1.437

589

20

Rabiller,C. et al.; Bulletin de la Societe Chimique de France; (1974); p. 3055 - 3058, View in Reaxys; Ogibin; Troyanskii; Nikishin; Bulletin of the Academy of Sciences of the USSR Division of Chemical Science; vol. 26; nb. 4; (1977); p. 767 - 771, View in Reaxys; Noller; Adams; Journal of the American Chemical Society; vol. 48; (1926); p. 1087, View in Reaxys; Goheen; Journal of the American Chemical Society; vol. 63; (1941); p. 744,747, View in Reaxys; Conn; Kistiakowsky; Smith; Journal of the American Chemical Society; vol. 61; (1939); p. 1868,1869, View in Reaxys; Grove; Walden; Journal of

Copyright © 2017 Reed Elsevier Properties SA. All rights reserved. Authorized use only. Reaxys® and the Reaxys® trademark are owned and protected by Reed Elsevier Properties SA and used under license.

29/119

2017-10-12 21:31:24

Chemical and Engineering Data; vol. 10; (1965); p. 98, View in Reaxys 1.4507

589

25

Fujihara et al.; Yukagaku; vol. 24; (1975); p. 654,657; Chem.Abstr.; vol. 84; nb. 59755n, View in Reaxys

1.4356

589

23.5

de Botton,M.; Bulletin de la Societe Chimique de France; (1975); p.

1773 - 1776, View in Reaxys; de Botton; Comptes Rendus des Seances de l'Academie des Sciences, Serie C: Sciences Chimiques; vol. 272; (1971); p. 118, View in Reaxys

1.4366

589

20

Wallach; Justus Liebigs Annalen der Chemie; vol. 353; (1907); p.

325; Chem. Zentralbl.; vol. 78; nb. II; (1907); p. 55, View in Reaxys; Mechtiew et al.; Azerbaidzhanskii Khimicheskii Zhurnal; vol. 4; (1973); p. 29,35; Chem.Abstr.; vol. 80; nb. 132868; (1974), View in Reaxys; Mechtiew et al.; Azerbaidzhanskii Khimicheskii Zhurnal; vol. 1; (1973); p. 47; Chem.Abstr.; vol. 80; nb. 59537; (1974), View in Reaxys; Jaworski; Kwiatkowski; Roczniki Chemii; vol. 48; (1974); p. 263,268, View in Reaxys

1.4354

589

25

Wolf; Helvetica Chimica Acta; vol. 55; (1972); p. 1446, View in Reaxys

1.4337

589

20

Mowsumsade et al.; Azerbaidzhanskii Khimicheskii Zhurnal; vol. 6; (1969); p. 86,88; Chem.Abstr.; vol. 74; nb. 53112; (1971), View in Reaxys

1.4352

589

20

Braidy,R.; Bulletin de la Societe Chimique de France; nb. 9; (1967); p. 3489 - 3495, View in Reaxys; Sellers; Sunner; Acta Chemica Scandinavica (1947-1973); vol. 16; (1962); p. 46,51, View in Reaxys

1.4342

589

25

Bell,J.M. et al.; Journal of Organic Chemistry; vol. 30; (1965); p.

4284 - 4292, View in Reaxys

1.4356

589

25

Mateos; Menchaca; Journal of Organic Chemistry; vol. 29; (1964); p. 2026, View in Reaxys

1.4325

589

27

Wheeler; Granell de Rodriguez; Journal of Organic Chemistry; vol.

29; (1964); p. 718, View in Reaxys

1.434

589

25

Kosower; Wu; Journal of the American Chemical Society; vol. 83; (1961); p. 3146, View in Reaxys

1.4368

589

20

Vogel; Journal of the Chemical Society; (1938); p. 1323,1328, View in Reaxys; Cetina; Mateos; Journal of Organic Chemistry; vol.

25; (1960); p. 704,706, View in Reaxys

1.43258

589

30

Kobe et al.; Industrial and Engineering Chemistry; vol. 47; (1955); p.

1767,1771, View in Reaxys

1.43474

589

25

Kobe et al.; Industrial and Engineering Chemistry; vol. 47; (1955); p.

1767,1771, View in Reaxys

1.4345

656.3

20

Vogel; Journal of the Chemical Society; (1938); p. 1323,1328, View in Reaxys

1.4424

486.1

20

Vogel; Journal of the Chemical Society; (1938); p. 1323,1328, View in Reaxys

1.4465

434

20

Vogel; Journal of the Chemical Society; (1938); p. 1323,1328, View in Reaxys

1.43917

589

15

Timmermans; Hennaut-Roland; Journal de Chimie Physique et de Physico-Chimie Biologique; vol. 34; (1937); p. 711; Chem. Zentralbl.; vol. 109; nb. II; (1938); p. 517, View in Reaxys

1.43645

687.8

15

Timmermans; Hennaut-Roland; Journal de Chimie Physique et de Physico-Chimie Biologique; vol. 34; (1937); p. 711; Chem. Zentralbl.; vol. 109; nb. II; (1938); p. 517, View in Reaxys

1.43679

656.3

15

Timmermans; Hennaut-Roland; Journal de Chimie Physique et de Physico-Chimie Biologique; vol. 34; (1937); p. 711; Chem. Zentralbl.; vol. 109; nb. II; (1938); p. 517, View in Reaxys

1.43934

587.6

15

Timmermans; Hennaut-Roland; Journal de Chimie Physique et de Physico-Chimie Biologique; vol. 34; (1937); p. 711; Chem. Zentralbl.; vol. 109; nb. II; (1938); p. 517, View in Reaxys

Copyright © 2017 Reed Elsevier Properties SA. All rights reserved. Authorized use only. Reaxys® and the Reaxys® trademark are owned and protected by Reed Elsevier Properties SA and used under license.

30/119

2017-10-12 21:31:24

1.44379

501.6

15

Timmermans; Hennaut-Roland; Journal de Chimie Physique et de Physico-Chimie Biologique; vol. 34; (1937); p. 711; Chem. Zentralbl.; vol. 109; nb. II; (1938); p. 517, View in Reaxys

1.44498

486.1

15

Timmermans; Hennaut-Roland; Journal de Chimie Physique et de Physico-Chimie Biologique; vol. 34; (1937); p. 711; Chem. Zentralbl.; vol. 109; nb. II; (1938); p. 517, View in Reaxys

1.44845

447.1

15

Timmermans; Hennaut-Roland; Journal de Chimie Physique et de Physico-Chimie Biologique; vol. 34; (1937); p. 711; Chem. Zentralbl.; vol. 109; nb. II; (1938); p. 517, View in Reaxys

1.4383

589

16

Vogel; Journal of the Chemical Society; (1928); p. 2025, View in Reaxys

1.4354

656.3

17.8

v. Auwers; Hinterseber; Treppmann; Justus Liebigs Annalen der Chemie; vol. 410; (1915); p. 267, View in Reaxys

1.438

589

17.8

v. Auwers; Hinterseber; Treppmann; Justus Liebigs Annalen der Chemie; vol. 410; (1915); p. 267, View in Reaxys

1.4434

486.1

17.8

v. Auwers; Hinterseber; Treppmann; Justus Liebigs Annalen der Chemie; vol. 410; (1915); p. 267, View in Reaxys

1.4482

434

17.8

v. Auwers; Hinterseber; Treppmann; Justus Liebigs Annalen der Chemie; vol. 410; (1915); p. 267, View in Reaxys

Density (33) 1 of 33

Density [g·cm-3]

0.934836

Measurement Temperature [°C]

34.99

Comment (Density)

Liquid

Sharma; Kataria; Solanki; Journal of Solution Chemistry; vol. 43; nb. 3; (2014); p. 486 - 524, View in Reaxys 2 of 33

Density [g·cm-3]

0.93968

Measurement Temperature [°C]

29.99

Comment (Density)

Liquid

Sharma; Kataria; Solanki; Journal of Solution Chemistry; vol. 43; nb. 3; (2014); p. 486 - 524, View in Reaxys 3 of 33

Density [g·cm-3]

0.944515

Measurement Temperature [°C]

24.99

Comment (Density)

Liquid

Sharma; Kataria; Solanki; Journal of Solution Chemistry; vol. 43; nb. 3; (2014); p. 486 - 524, View in Reaxys 4 of 33

Density [g·cm-3]

0.949342

Measurement Temperature [°C]

19.99

Comment (Density)

Liquid

Sharma; Kataria; Solanki; Journal of Solution Chemistry; vol. 43; nb. 3; (2014); p. 486 - 524, View in Reaxys 5 of 33

Density [g·cm-3]

0.94379

Measurement Temperature [°C]

25

Hovorka, Stipan; Roux, Alain H.; Roux-Desgranges, Genevieve; Donnal, Vladimir; Journal of Solution Chemistry; vol. 28; nb. 12; (1999); p. 1289 - 1305, View in Reaxys 6 of 33

Density [g·cm-3]

0.93901

Measurement Temperature [°C]

30

Venkatesu; Rao, M. V. Prabhakara; Journal of Chemical Thermodynamics; vol. 30; nb. 2; (1998); p. 207 - 213, View in Reaxys

Copyright © 2017 Reed Elsevier Properties SA. All rights reserved. Authorized use only. Reaxys® and the Reaxys® trademark are owned and protected by Reed Elsevier Properties SA and used under license.

31/119

2017-10-12 21:31:24

7 of 33

Density [g·cm-3]

0.944

Measurement Temperature [°C]

25

Dernini; Polcaro; Ricci; Maronglu; Journal of Chemical and Engineering Data; vol. 32; nb. 2; (1987); p. 194 - 195, View in Reaxys 8 of 33

Density [g·cm-3]

0.89974

Measurement Temperature [°C]

40

Sreenivasulu; Naidu; Australian Journal of Chemistry; vol. 32; (1979); p. 1649,1650,1651, View in Reaxys 9 of 33

Density [g·cm-3]

0.93898

Measurement Temperature [°C]

30

Sreenivasulu; Naidu; Australian Journal of Chemistry; vol. 32; (1979); p. 1649,1650,1651, View in Reaxys 10 of 33

Density [g·cm-3]

0.93896

Measurement Temperature [°C]

30

Rao; Naidu; Journal of Chemical Thermodynamics; vol. 8; (1976); p. 73,74, 75, View in Reaxys 11 of 33

Rao; Naidu; Journal of Chemical Thermodynamics; vol. 8; (1976); p. 73,74, 75, View in Reaxys

12 of 33

Density [g·cm-3]

0.9536

Reference Temperature [°C]

4

Measurement Temperature [°C]

25

Fujihara et al.; Yukagaku; vol. 24; (1975); p. 654,657; Chem.Abstr.; vol. 84; nb. 59755n, View in Reaxys 13 of 33

Density [g·cm-3]

0.95

Reference Temperature [°C]

4

Measurement Temperature [°C]

20

Rabiller,C. et al.; Bulletin de la Societe Chimique de France; (1974); p. 3055 - 3058, View in Reaxys 14 of 33

Density [g·cm-3]

0.948

Reference Temperature [°C]

4

Measurement Temperature [°C]

20

Mechtiew et al.; Azerbaidzhanskii Khimicheskii Zhurnal; vol. 4; (1973); p. 29,35; Chem.Abstr.; vol. 80; nb. 132868; (1974), View in Reaxys; Mechtiew et al.; Azerbaidzhanskii Khimicheskii Zhurnal; vol. 1; (1973); p. 47; Chem.Abstr.; vol. 80; nb. 59537; (1974), View in Reaxys 15 of 33

Density [g·cm-3]

0.944

Reference Temperature [°C]

4

Measurement Temperature [°C]

25

Wolf; Helvetica Chimica Acta; vol. 55; (1972); p. 1446, View in Reaxys 16 of 33

Density [g·cm-3]

0.948

Measurement Temperature [°C]

20

Type (Density)

crystallographic

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Braidy,R.; Bulletin de la Societe Chimique de France; nb. 9; (1967); p. 3489 - 3495, View in Reaxys; Wallach; Justus Liebigs Annalen der Chemie; vol. 353; (1907); p. 325; Chem. Zentralbl.; vol. 78; nb. II; (1907); p. 55, View in Reaxys 17 of 33

Density [g·cm-3]

0.94368

Reference Temperature [°C]

4

Measurement Temperature [°C]

25

Sellers; Sunner; Acta Chemica Scandinavica (1947-1973); vol. 16; (1962); p. 46,51, View in Reaxys 18 of 33

Density [g·cm-3]

0.8819 - 0.9495

Reference Temperature [°C]

4

Measurement Temperature [°C]

20 - 90

Kuss; Z. ang. Phys.; vol. 7; (1955); p. 372,376, View in Reaxys 19 of 33

Density [g·cm-3]

0.9487

Reference Temperature [°C]

4

Measurement Temperature [°C]

20

Goheen; Journal of the American Chemical Society; vol. 63; (1941); p. 744,747, View in Reaxys 20 of 33

Density [g·cm-3]

0.945

Reference Temperature [°C]

4

Measurement Temperature [°C]

20

Vogel; Journal of the Chemical Society; (1938); p. 1323,1328, View in Reaxys 21 of 33

Density [g·cm-3]

0.9075

Reference Temperature [°C]

4

Measurement Temperature [°C]

64.4

Vogel; Journal of the Chemical Society; (1938); p. 1323,1328, View in Reaxys 22 of 33

Density [g·cm-3]

0.8857

Reference Temperature [°C]

4

Measurement Temperature [°C]

87.4

Vogel; Journal of the Chemical Society; (1938); p. 1323,1328, View in Reaxys 23 of 33

Density [g·cm-3]

0.968

Reference Temperature [°C]

4

Measurement Temperature [°C]

0

Timmermans; Hennaut-Roland; Journal de Chimie Physique et de Physico-Chimie Biologique; vol. 34; (1937); p.

711; Chem. Zentralbl.; vol. 109; nb. II; (1938); p. 517, View in Reaxys 24 of 33

Density [g·cm-3]

0.95353

Reference Temperature [°C]

4

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Measurement Temperature [°C]

15

Timmermans; Hennaut-Roland; Journal de Chimie Physique et de Physico-Chimie Biologique; vol. 34; (1937); p.

711; Chem. Zentralbl.; vol. 109; nb. II; (1938); p. 517, View in Reaxys 25 of 33

Density [g·cm-3]

0.9525

Measurement Temperature [°C]

15

Mohler; Lohr; Helvetica Chimica Acta; vol. 20; (1937); p. 1183,1185, View in Reaxys 26 of 33

Density [g·cm-3]

0.941

Reference Temperature [°C]

4

Measurement Temperature [°C]

20

Ruzicka; Giacomello; Helvetica Chimica Acta; vol. 20; (1937); p. 548,555, View in Reaxys 27 of 33

Density [g·cm-3]

0.93902

Reference Temperature [°C]

4

Measurement Temperature [°C]

30

Timmermans; Hennaut-Roland; Journal de Chimie Physique et de Physico-Chimie Biologique; vol. 34; (1937); p.

711; Chem. Zentralbl.; vol. 109; nb. II; (1938); p. 517, View in Reaxys 28 of 33

Density [g·cm-3]

0.8871

Reference Temperature [°C]

4

Measurement Temperature [°C]

86.4

Vogel; Journal of the Chemical Society; (1928); p. 2025, View in Reaxys 29 of 33

Density [g·cm-3]

0.9099

Reference Temperature [°C]

4

Measurement Temperature [°C]

62.8

Vogel; Journal of the Chemical Society; (1928); p. 2025, View in Reaxys 30 of 33

Density [g·cm-3]

0.9518

Reference Temperature [°C]

4

Measurement Temperature [°C]

16.4

Vogel; Journal of the Chemical Society; (1928); p. 2025, View in Reaxys 31 of 33

Density [g·cm-3]

0.9502

Reference Temperature [°C]

4

Measurement Temperature [°C]

20

Noller; Adams; Journal of the American Chemical Society; vol. 48; (1926); p. 1087, View in Reaxys 32 of 33

Density [g·cm-3]

0.9509

Reference Temperature [°C]

4

Measurement Temperature [°C]

18.2

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v. Auwers; Hinterseber; Treppmann; Justus Liebigs Annalen der Chemie; vol. 410; (1915); p. 267, View in Reaxys 33 of 33

Density [g·cm-3]

0.9416

Reference Temperature [°C]

4

Measurement Temperature [°C]

21.5

Hentzschel; Wislicenus,J.; Justus Liebigs Annalen der Chemie; vol. 275; (1893); p. 313, View in Reaxys Adsorption (MCS) (6) 1 of 6

Description (Adsorption (MCS))

Further physical properties of the adsorbed molecule

Partner (Adsorption (MCS))

β-Mo2C

Siaj, Mohamed; Temprano, Israel; Dubuc, Nathalie; McBreen, Peter H.; Journal of Organometallic Chemistry; vol. 691; nb. 24-25; (2006); p. 5497 - 5504, View in Reaxys 2 of 6

Description (Adsorption (MCS))

Adsorption

Temperature (Adsorption (MCS)) [°C]

25 - 45

Partner (Adsorption (MCS))

quartz sand

Arp, Hans Peter H.; Goss, Kai-Uwe; Schwarzenbach, Rene P.; Environmental Toxicology and Chemistry; vol. 25; nb. 1; (2006); p. 45 - 51, View in Reaxys 3 of 6

Description (Adsorption (MCS))

Enthalpy of adsorption

Temperature (Adsorption (MCS)) [°C]

15

Partner (Adsorption (MCS))

quartz sand

Arp, Hans Peter H.; Goss, Kai-Uwe; Schwarzenbach, Rene P.; Environmental Toxicology and Chemistry; vol. 25; nb. 1; (2006); p. 45 - 51, View in Reaxys 4 of 6

Description (Adsorption (MCS))

Adsorption

Partner (Adsorption (MCS))

poly(styrene-co-divinylbenzene) <Poly(Sty-co-DVB)>

Errede, L. A.; Journal of Physical Chemistry; vol. 95; nb. 4; (1991); p. 1836 - 1843, View in Reaxys 5 of 6

Description (Adsorption (MCS))

Desorption

Temperature (Adsorption (MCS)) [°C]

115 - 183

Partner (Adsorption (MCS))

silica gel

Chen, Xiao; Smart, Ronald B.; Applied Spectroscopy; vol. 45; nb. 8; (1991); p. 1322 - 1326, View in Reaxys 6 of 6

Description (Adsorption (MCS))

Adsorption

Cornford et al.; Transactions of the Faraday Society; vol. 58; (1962); p. 74,78, View in Reaxys; Davydov et al.; Russian Journal of Physical Chemistry; vol. 39; (1965); p. 1096; Zhurnal Fizicheskoi Khimii; p. 2058, View in Reaxys Association (MCS) (67) 1 of 67

Description (Association Further physical properties of the complex (MCS)) Solvent (Association (MCS))

methanol; H2O

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Partner (Association (MCS))

cucurbituril

Osaka, Issey; Kondou, Masanobu; Selvapalam, Narayanan; Samal, Shashadhar; Kim, Kimoon; Rekharsky, Mikhail V.; Inoue, Yoshihisa; Arakawa, Ryuichi; Journal of Mass Spectrometry; vol. 41; nb. 2; (2006); p. 202 207, View in Reaxys 2 of 67

Description (Association Association with compound (MCS)) Solvent (Association (MCS))

CCl4

Partner (Association (MCS))

methanol

Vokin; Oznobikhina; Shulunova; Fedorov; Turchaninov; Russian Journal of General Chemistry; vol. 75; nb. 10; (2005); p. 1566 - 1575, View in Reaxys 3 of 67

Description (Association Further physical properties of the complex (MCS)) Temperature (Association (MCS)) [°C]

30

Partner (Association (MCS))

N,N-dimethyl-formamide; propan-1-ol

Venkatesu; Rao, M. V. Prabhakara; Journal of Chemical Thermodynamics; vol. 30; nb. 2; (1998); p. 207 - 213, View in Reaxys 4 of 67

Description (Association Further physical properties of the complex (MCS)) Temperature (Association (MCS)) [°C]

30

Partner (Association (MCS))

N,N-dimethyl-formamide; butan-1-ol

Venkatesu; Rao, M. V. Prabhakara; Journal of Chemical Thermodynamics; vol. 30; nb. 2; (1998); p. 207 - 213, View in Reaxys 5 of 67

Description (Association Further physical properties of the complex (MCS)) Temperature (Association (MCS)) [°C]

30

Partner (Association (MCS))

N,N-dimethyl-formamide; pentan-1-ol

Venkatesu; Rao, M. V. Prabhakara; Journal of Chemical Thermodynamics; vol. 30; nb. 2; (1998); p. 207 - 213, View in Reaxys 6 of 67

Description (Association Further physical properties of the complex (MCS)) Temperature (Association (MCS)) [°C]

30

Partner (Association (MCS))

N,N-dimethyl-formamide; hexan-1-ol

Venkatesu; Rao, M. V. Prabhakara; Journal of Chemical Thermodynamics; vol. 30; nb. 2; (1998); p. 207 - 213, View in Reaxys 7 of 67

Description (Association Further physical properties of the complex (MCS)) Temperature (Association (MCS)) [°C]

30

Partner (Association (MCS))

N,N-dimethyl-formamide

Venkatesu; Rao, M. V. Prabhakara; Journal of Chemical Thermodynamics; vol. 30; nb. 2; (1998); p. 207 - 213, View in Reaxys

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8 of 67

Description (Association Association with compound (MCS)) Partner (Association (MCS))

2,2'-bis(1-hydroxy-4,5-dihydro-2:3,6:7-dibenzocycloheptatrien-1-yl)biphenyl

Weber; Wierig; Skobridis; Advanced Synthesis and Catalysis; vol. 338; nb. 6; (1996); p. 553 - 557, View in Reaxys 9 of 67

Description (Association Association with compound (MCS)) Partner (Association (MCS))

2,2'-bis(1-hydroxy-2:3,6:7-dibenzocycloheptatrien-1-yl)biphenyl

Weber; Wierig; Skobridis; Advanced Synthesis and Catalysis; vol. 338; nb. 6; (1996); p. 553 - 557, View in Reaxys 10 of 67

Description (Association Association with compound (MCS)) Partner (Association (MCS))

2,2'-bis(1-hydroxy-2:3,4:5,6:7-tribenzocycloheptatrien-1-yl)biphenyl

Weber; Wierig; Skobridis; Advanced Synthesis and Catalysis; vol. 338; nb. 6; (1996); p. 553 - 557, View in Reaxys 11 of 67

Description (Association Association with compound (MCS)) Partner (Association (MCS))

2,2'-bis(1-hydroxy-3'',6''-epoxy-3'',6''-dihydro-2:3,4:5,6:7-tribenzocycloheptatrien-1-yl)biphenyl

Weber; Wierig; Skobridis; Advanced Synthesis and Catalysis; vol. 338; nb. 6; (1996); p. 553 - 557, View in Reaxys 12 of 67

Description (Association Association with compound (MCS)) Partner (Association (MCS))

biphenyl-2,2'-diylbis(9-hydroxyxanthene)

Weber; Wierig; Skobridis; Advanced Synthesis and Catalysis; vol. 338; nb. 6; (1996); p. 553 - 557, View in Reaxys 13 of 67

Description (Association Association with compound (MCS)) Partner (Association (MCS))

2,2'-bis(2,7-di-tert-butyl-9-hydroxyfluoren-9-yl)biphenyl

Weber; Wierig; Skobridis; Advanced Synthesis and Catalysis; vol. 338; nb. 6; (1996); p. 553 - 557, View in Reaxys 14 of 67

Description (Association Association with compound (MCS)) Partner (Association (MCS))

9,9'-lt;2,2'-(1,1'-biphenyl)ylenegt;bis(9H-fluoren-9-ol)

Weber; Wierig; Skobridis; Advanced Synthesis and Catalysis; vol. 338; nb. 6; (1996); p. 553 - 557, View in Reaxys 15 of 67

Description (Association Stability constant of the complex with ...

(MCS)) Solvent (Association (MCS))

H2O

Temperature (Association (MCS)) [°C]

25

Partner (Association (MCS))

alpha cyclodextrin

Tee, Oswald S.; Fedortchenko, Alexei A.; Loncke, Paul G.; Gadosy, Timothy A.; Journal of the Chemical Society, Perkin Transactions 2: Physical Organic Chemistry (1972-1999); nb. 6; (1996); p. 1243 - 1250, View in Reaxys 16 of 67

Description (Association Stability constant of the complex with ...

(MCS)) Solvent (Association (MCS))

H2O

Temperature (Association (MCS)) [°C]

25

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Partner (Association (MCS))

β‐cyclodextrin

Tee, Oswald S.; Fedortchenko, Alexei A.; Loncke, Paul G.; Gadosy, Timothy A.; Journal of the Chemical Society, Perkin Transactions 2: Physical Organic Chemistry (1972-1999); nb. 6; (1996); p. 1243 - 1250, View in Reaxys 17 of 67

Description (Association Stability constant of the complex with ...

(MCS)) Partner (Association (MCS))

cucurbituril; 0.2M aq. Na2SO4

Jeon, You-Moon; Kim, Jaheon; Whang, Dongmok; Kim, Kimoon; Journal of the American Chemical Society; vol.

118; nb. 40; (1996); p. 9790 - 9791, View in Reaxys 18 of 67

Description (Association NMR spectrum of the complex (MCS)) Solvent (Association (MCS))

solid

Partner (Association (MCS))

TiCl4

Maier, Guenther; Kalinowski, Hans-Otto; Weber, Claudia; Henrich, Markus; Magnetic Resonance in Chemistry; vol. 33; nb. 4; (1995); p. 290 - 296, View in Reaxys 19 of 67

Description (Association NMR spectrum of the complex (MCS)) Solvent (Association (MCS))

CDCl3

Temperature (Association (MCS)) [°C]

25

Partner (Association (MCS))

C144H136O24

Robbins, Timothy A.; Knobler, Carolyn B.; Bellew, Donald R.; Cram, Donald J.; Journal of the American Chemical Society; vol. 116; nb. 1; (1994); p. 111 - 122, View in Reaxys 20 of 67

Description (Association IR spectrum of the complex (MCS)) Solvent (Association (MCS))

solid matrix

Partner (Association (MCS))

SbF5

Vancik, Hrvoj; Gabelica, Vesna; Mihalic, Zlatko; Sunko, Dionis E.; Journal of the Chemical Society, Perkin Transactions 2: Physical Organic Chemistry (1972-1999); nb. 7; (1994); p. 1611 - 1614, View in Reaxys 21 of 67

Description (Association Association with compound (MCS)) Solvent (Association (MCS))

H2O

Partner (Association (MCS))

alpha cyclodextrin

Wulff, Guenter; Kubik, Stefan; Carbohydrate Research; vol. 237; nb. 1; (1992); p. 1 - 10, View in Reaxys 22 of 67

Description (Association Association with compound (MCS)) Solvent (Association (MCS))

H2O

Partner (Association (MCS))

β‐cyclodextrin

Wulff, Guenter; Kubik, Stefan; Carbohydrate Research; vol. 237; nb. 1; (1992); p. 1 - 10, View in Reaxys 23 of 67

Description (Association Association with compound (MCS))

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Solvent (Association (MCS))

H2O

Partner (Association (MCS))

cyclomaltooctaose

Wulff, Guenter; Kubik, Stefan; Carbohydrate Research; vol. 237; nb. 1; (1992); p. 1 - 10, View in Reaxys 24 of 67

Description (Association Association with compound (MCS)) Solvent (Association (MCS))

H2O

Partner (Association (MCS))

amylose

Wulff, Guenter; Kubik, Stefan; Carbohydrate Research; vol. 237; nb. 1; (1992); p. 1 - 10, View in Reaxys 25 of 67

Description (Association Further physical properties of the complex (MCS)) Solvent (Association (MCS))

H2O

Partner (Association (MCS))

alpha cyclodextrin

Wulff, Guenter; Kubik, Stefan; Carbohydrate Research; vol. 237; nb. 1; (1992); p. 1 - 10, View in Reaxys 26 of 67

Description (Association Further physical properties of the complex (MCS)) Solvent (Association (MCS))

H2O

Partner (Association (MCS))

β‐cyclodextrin

Wulff, Guenter; Kubik, Stefan; Carbohydrate Research; vol. 237; nb. 1; (1992); p. 1 - 10, View in Reaxys 27 of 67

Description (Association Further physical properties of the complex (MCS)) Solvent (Association (MCS))

H2O

Partner (Association (MCS))

cyclomaltooctaose

Wulff, Guenter; Kubik, Stefan; Carbohydrate Research; vol. 237; nb. 1; (1992); p. 1 - 10, View in Reaxys 28 of 67

Description (Association Further physical properties of the complex (MCS)) Solvent (Association (MCS))

H2O

Partner (Association (MCS))

amylose

Wulff, Guenter; Kubik, Stefan; Carbohydrate Research; vol. 237; nb. 1; (1992); p. 1 - 10, View in Reaxys 29 of 67

Description (Association Association with compound (MCS)) Solvent (Association (MCS))

solid

Partner (Association (MCS))

1,1,3,3-Tetrakis(4-tert-butylphenyl)allen

Weber, Edwin; Seichter, Wilhelm; Goldberg, Israel; Chemische Berichte; vol. 123; nb. 4; (1990); p. 811 - 820, View in Reaxys 30 of 67

Description (Association Further physical properties of the complex (MCS))

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Partner (Association (MCS))

Hexadecane

Abraham, Michael H.; Whiting, Gary S.; Fuchs, Richard; Chambers, Eric J.; Journal of the Chemical Society, Perkin Transactions 2: Physical Organic Chemistry (1972-1999); nb. 2; (1990); p. 290 - 291, View in Reaxys 31 of 67

Description (Association Association with compound (MCS)) Partner (Association (MCS))

(+)-4,4',6,6'-tetrachloro-2,2'-bis(hydroxydiphenylmethyl)biphenyl

Toda, Fumio; Toyotaka, Ritsuji; Fukuda, Hideji; Tetrahedron: Asymmetry; vol. 1; nb. 5; (1990); p. 303 - 306, View in Reaxys 32 of 67

Description (Association Association with compound (MCS)) Partner (Association (MCS))

(-)-4,4',6,6'-tetrachloro-2,2'-bis(hydroxydiphenylmethyl)biphenyl

Toda, Fumio; Toyotaka, Ritsuji; Fukuda, Hideji; Tetrahedron: Asymmetry; vol. 1; nb. 5; (1990); p. 303 - 306, View in Reaxys 33 of 67

Description (Association IR spectrum of the complex (MCS)) Solvent (Association (MCS))

CCl4

Temperature (Association (MCS)) [°C]

50

Partner (Association (MCS))

phenol

Jeng, Mei-Lee H.; Li, Ying-Sing; Spectrochimica Acta, Part A: Molecular and Biomolecular Spectroscopy; vol. 45; nb. 5; (1989); p. 525 - 532, View in Reaxys 34 of 67

Description (Association Stability constant of the complex with ...

(MCS)) Temperature (Association (MCS)) [°C]

24.9 - 49.9

Partner (Association (MCS))

phenol

Jeng, Mei-Lee H.; Li, Ying-Sing; Spectrochimica Acta, Part A: Molecular and Biomolecular Spectroscopy; vol. 45; nb. 5; (1989); p. 525 - 532, View in Reaxys 35 of 67

Description (Association Stability constant of the complex with ...

(MCS)) Solvent (Association (MCS))

CCl4

Temperature (Association (MCS)) [°C]

25

Partner (Association (MCS))

chloranil

Andrews, L. J.; Keefer, R. M.; Journal of Organic Chemistry; vol. 53; nb. 10; (1988); p. 2163 - 2166, View in Reaxys 36 of 67

Description (Association Association with compound (MCS)) Temperature (Association (MCS)) [°C]

25

Partner (Association (MCS))

water

Kamlet, Mortimer J.; Doherty, Ruth M.; Abraham, Michael H.; Carr, Peter W.; Doherty, Robert F.; Taft, Robert W.; Journal of Physical Chemistry; vol. 91; nb. 7; (1987); p. 1996 - 2004, View in Reaxys

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37 of 67

Description (Association Association with compound (MCS)) Partner (Association (MCS))

tetrachloromethane

Guanquan, Che; Ott, J. Bevan; Goates, J. Rex; Journal of Chemical Thermodynamics; vol. 18; nb. 4; (1986); p.

323 - 330, View in Reaxys 38 of 67

Description (Association Stability constant of the complex with ...

(MCS)) Solvent (Association (MCS))

CCl4

Temperature (Association (MCS)) [°C]

22 - 50

Partner (Association (MCS))

phenol

Sverdlova, O. V.; Yatsenko-Khmelevskaya, M. A.; Nikolaev, V. A.; Journal of Organic Chemistry USSR (English Translation); vol. 21; nb. 1; (1985); p. 54 - 59; Zhurnal Organicheskoi Khimii; vol. 21; nb. 1; (1985); p. 61 - 67, View in Reaxys 39 of 67

Description (Association Enthalpy of association (MCS)) Solvent (Association (MCS))

CCl4

Partner (Association (MCS))

phenol

Sverdlova, O. V.; Yatsenko-Khmelevskaya, M. A.; Nikolaev, V. A.; Journal of Organic Chemistry USSR (English Translation); vol. 21; nb. 1; (1985); p. 54 - 59; Zhurnal Organicheskoi Khimii; vol. 21; nb. 1; (1985); p. 61 - 67, View in Reaxys 40 of 67

Description (Association Enthalpy of association (MCS)) Solvent (Association (MCS))

CH2Cl2

Temperature (Association (MCS)) [°C]

25

Partner (Association (MCS))

boron trifluoride

Maria, Pierre-Charles; Gal, Jean-Francois; Journal of Physical Chemistry; vol. 89; nb. 7; (1985); p. 1296 - 1304, View in Reaxys 41 of 67

Description (Association IR spectrum of the complex (MCS)) Solvent (Association (MCS))

CCl4

Temperature (Association (MCS)) [°C]

20

Partner (Association (MCS))

diisopropyl-2,6-nitro-4-phenol-d1

Laurence, Christian; Berthelot, Michel; Helbert, Maryvonne; Spectrochimica Acta, Part A: Molecular and Biomolecular Spectroscopy; vol. 41; nb. 7; (1985); p. 883 - 892, View in Reaxys 42 of 67

Description (Association IR spectrum of the complex (MCS)) Solvent (Association (MCS))

CCl4

Temperature (Association (MCS)) [°C]

20

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Partner (Association (MCS))

pyrrole

Laurence, Christian; Berthelot, Michel; Helbert, Maryvonne; Spectrochimica Acta, Part A: Molecular and Biomolecular Spectroscopy; vol. 41; nb. 7; (1985); p. 883 - 892, View in Reaxys 43 of 67

Description (Association IR spectrum of the complex (MCS)) Solvent (Association (MCS))

CCl4

Temperature (Association (MCS)) [°C]

20

Partner (Association (MCS))

para-nitrobenzenethiol

Laurence, Christian; Berthelot, Michel; Helbert, Maryvonne; Spectrochimica Acta, Part A: Molecular and Biomolecular Spectroscopy; vol. 41; nb. 7; (1985); p. 883 - 892, View in Reaxys 44 of 67

Description (Association Association with compound (MCS)) Solvent (Association (MCS))

CCl4

Temperature (Association (MCS)) [°C]

20

Partner (Association (MCS))

propynoic acid ethyl ester

Laurence, Christian; Berthelot, Michel; Helbert, Maryvonne; Spectrochimica Acta, Part A: Molecular and Biomolecular Spectroscopy; vol. 41; nb. 7; (1985); p. 883 - 892, View in Reaxys 45 of 67

Description (Association Association with compound (MCS)) Solvent (Association (MCS))

CCl4

Temperature (Association (MCS)) [°C]

20

Partner (Association (MCS))

N-methyl(p-nitroaniline)

Laurence, Christian; Berthelot, Michel; Helbert, Maryvonne; Spectrochimica Acta, Part A: Molecular and Biomolecular Spectroscopy; vol. 41; nb. 7; (1985); p. 883 - 892, View in Reaxys 46 of 67

Description (Association Association with compound (MCS)) Solvent (Association (MCS))

CCl4

Temperature (Association (MCS)) [°C]

20

Partner (Association (MCS))

pyrrole

Laurence, Christian; Berthelot, Michel; Helbert, Maryvonne; Spectrochimica Acta, Part A: Molecular and Biomolecular Spectroscopy; vol. 41; nb. 7; (1985); p. 883 - 892, View in Reaxys 47 of 67

Description (Association Association with compound (MCS)) Solvent (Association (MCS))

CCl4

Temperature (Association (MCS)) [°C]

20

Partner (Association (MCS))

para-nitrobenzenethiol

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Laurence, Christian; Berthelot, Michel; Helbert, Maryvonne; Spectrochimica Acta, Part A: Molecular and Biomolecular Spectroscopy; vol. 41; nb. 7; (1985); p. 883 - 892, View in Reaxys 48 of 67

Description (Association Association with compound (MCS)) Solvent (Association (MCS))

CCl4

Temperature (Association (MCS)) [°C]

20

Partner (Association (MCS))

methanol

Laurence, Christian; Berthelot, Michel; Helbert, Maryvonne; Spectrochimica Acta, Part A: Molecular and Biomolecular Spectroscopy; vol. 41; nb. 7; (1985); p. 883 - 892, View in Reaxys 49 of 67

Description (Association Association with compound (MCS)) Solvent (Association (MCS))

CCl4

Temperature (Association (MCS)) [°C]

20

Partner (Association (MCS))

diisopropyl-2,6-nitro-4-phenol-d1

Laurence, Christian; Berthelot, Michel; Helbert, Maryvonne; Spectrochimica Acta, Part A: Molecular and Biomolecular Spectroscopy; vol. 41; nb. 7; (1985); p. 883 - 892, View in Reaxys 50 of 67

Description (Association Association with compound (MCS)) Temperature (Association (MCS)) [°C]

20

Partner (Association (MCS))

phenol

Laurence, Christian; Berthelot, Michel; Helbert, Maryvonne; Spectrochimica Acta, Part A: Molecular and Biomolecular Spectroscopy; vol. 41; nb. 7; (1985); p. 883 - 892, View in Reaxys 51 of 67

Description (Association Association with compound (MCS)) Temperature (Association (MCS)) [°C]

20

Partner (Association (MCS))

2,6-diisopropylphenol

Laurence, Christian; Berthelot, Michel; Helbert, Maryvonne; Spectrochimica Acta, Part A: Molecular and Biomolecular Spectroscopy; vol. 41; nb. 7; (1985); p. 883 - 892, View in Reaxys 52 of 67

Description (Association Association with compound (MCS)) Temperature (Association (MCS)) [°C]

20

Partner (Association (MCS))

4-nitro-phenol

Laurence, Christian; Berthelot, Michel; Helbert, Maryvonne; Spectrochimica Acta, Part A: Molecular and Biomolecular Spectroscopy; vol. 41; nb. 7; (1985); p. 883 - 892, View in Reaxys 53 of 67

Description (Association Association with compound (MCS)) Temperature (Association (MCS)) [°C]

20

Partner (Association (MCS))

2,6-Diisopropyl-4-nitrophenol

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Laurence, Christian; Berthelot, Michel; Helbert, Maryvonne; Spectrochimica Acta, Part A: Molecular and Biomolecular Spectroscopy; vol. 41; nb. 7; (1985); p. 883 - 892, View in Reaxys 54 of 67

Description (Association Enthalpy of association (MCS)) Solvent (Association (MCS))

CH2Cl2

Partner (Association (MCS))

BF3

Berthelot, Michel; Gal, Jean-Francois; Helbert, Maryvonne; Laurence, Christian; Maria, Pierre-Charles; Journal de Chimie Physique et de Physico-Chimie Biologique; vol. 82; nb. 4; (1985); p. 427 - 432, View in Reaxys 55 of 67

Description (Association NMR spectrum of the complex (MCS)) Solvent (Association (MCS))

neat (no solvent)

Temperature (Association (MCS)) [°C]

27

Partner (Association (MCS))

LiClO4

Murthy, Adurthy S.N.; Bhardwaj, Anand P.; Journal of the Chemical Society, Perkin Transactions 2: Physical Organic Chemistry (1972-1999); (1984); p. 727 - 730, View in Reaxys 56 of 67

Description (Association NMR spectrum of the complex (MCS)) Solvent (Association (MCS))

neat (no solvent)

Temperature (Association (MCS)) [°C]

27

Partner (Association (MCS))

NaClO4

Murthy, Adurthy S.N.; Bhardwaj, Anand P.; Journal of the Chemical Society, Perkin Transactions 2: Physical Organic Chemistry (1972-1999); (1984); p. 727 - 730, View in Reaxys 57 of 67

Description (Association NMR spectrum of the complex (MCS)) Solvent (Association (MCS))

neat (no solvent)

Temperature (Association (MCS)) [°C]

27

Partner (Association (MCS))

Mg(ClO4)2

Murthy, Adurthy S.N.; Bhardwaj, Anand P.; Journal of the Chemical Society, Perkin Transactions 2: Physical Organic Chemistry (1972-1999); (1984); p. 727 - 730, View in Reaxys 58 of 67

Description (Association NMR spectrum of the complex (MCS)) Partner (Association (MCS))

Methyl fluoride; SbF5

Abdel-Malik, Magdy Malak; Dean, Philip Arthur Woodworth; King, James Frederick; Canadian Journal of Chemistry; vol. 62; (1984); p. 69 - 73, View in Reaxys 59 of 67

Description (Association IR spectrum of the complex (MCS)) Solvent (Association (MCS))

CCl4

Partner (Association (MCS))

tert.-butylhydroperoxide

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Voronenkov, V. V.; Ushakova, G. B.; Yablonskii, O. P.; Kazakova, G. S.; Russian Journal of Physical Chemistry; vol. 58; (1984); p. 764; Zhurnal Fizicheskoi Khimii; vol. 58; (1984); p. 1254, View in Reaxys 60 of 67

Description (Association Spectrum of the complex (MCS)) Rider; Hammaker; Spectrochimica Acta, Part A: Molecular and Biomolecular Spectroscopy; vol. 29; (1973); p. 501, View in Reaxys; Devaure et al.; Journal de Chimie Physique et de Physico-Chimie Biologique; vol. 70; (1973); p.

1448, View in Reaxys; Chen; Chen; Journal of the Chinese Chemical Society (Taipei, Taiwan); vol. 22; (1975); p.

279, View in Reaxys; Kelm; Brauer; Zeitschrift fuer Physikalische Chemie (Muenchen, Germany); vol. 78; (1972); p.

225,228, View in Reaxys; Le Fevre et al.; Journal of the Chemical Society [Section] B: Physical Organic; (1968); p.

148, View in Reaxys; Morrison et al.; Journal of Organic Chemistry; vol. 34; (1969); p. 1497, View in Reaxys

61 of 67

Description (Association Association with compound (MCS)) Gorshkova et al.; Bulletin of the Academy of Sciences of the USSR, Division of Chemical Science (English Translation); (1970); p. 506; Izvestiya Akademii Nauk SSSR, Seriya Khimicheskaya; (1970); p. 550, View in Reaxys; Patterson; Hammaker; Journal of Physical Chemistry; vol. 70; (1966); p. 3745, View in Reaxys; Lauransan; Pineau; Journal de Chimie Physique et de Physico-Chimie Biologique; vol. 65; (1968); p. 1937, View in Reaxys; Pullin; Werner; Spectrochimica Acta; vol. 21; (1965); p. 1257, View in Reaxys; Devaure et al.; Journal de Chimie Physique et de Physico-Chimie Biologique; vol. 70; (1973); p. 1448, View in Reaxys; Cantacuzene; Bulletin de la Societe Chimique de France; (1962); p. 757, View in Reaxys; Loiseleur et al.; Journal de Chimie Physique et de Physico-Chimie Biologique; vol. 64; (1967); p. 634, View in Reaxys; Bellamy; Pace; Spectrochimica Acta, Part A: Molecular and Biomolecular Spectroscopy; vol. 25; (1969); p. 319,322, View in Reaxys; Hoeke; Koevoet; Recueil des Travaux Chimiques des Pays-Bas; vol. 82; (1963); p. 17,19, View in Reaxys; Gramstad; Spectrochimica Acta; vol. 19; (1963); p. 497,499, View in Reaxys; Dunken; Winde; Zeitschrift fuer Physikalische Chemie (Muenchen, Germany); vol. 56; (1967); p. 303, View in Reaxys

62 of 67

Description (Association Stability constant of the complex with ...

(MCS)) Ling et al.; Journal of Physical Chemistry; vol. 70; (1966); p. 901, View in Reaxys; Kelm; Brauer; Zeitschrift fuer Physikalische Chemie (Muenchen, Germany); vol. 78; (1972); p. 225,228, View in Reaxys

63 of 67

Description (Association Enthalpy of association (MCS)) Sellier; Wojtkowiak; Journal de Chimie Physique et de Physico-Chimie Biologique; vol. 65; (1968); p. 936, View in Reaxys; Kelm; Brauer; Zeitschrift fuer Physikalische Chemie (Muenchen, Germany); vol. 78; (1972); p.

225,228, View in Reaxys

64 of 67

Description (Association Further physical properties of the complex (MCS)) Kelm; Brauer; Zeitschrift fuer Physikalische Chemie (Muenchen, Germany); vol. 78; (1972); p. 225,228, View in Reaxys

65 of 67

Description (Association Association with compound (MCS)) Partner (Association (MCS))

deuteromethanol

Tamres; Searles; Journal of the American Chemical Society; vol. 81; (1959); p. 2100, View in Reaxys 66 of 67

Description (Association Association with compound (MCS)) Partner (Association (MCS))

phenol

Chiurdoglu et al.; Chemistry and Industry (London, United Kingdom); (1959); p. 1453, View in Reaxys 67 of 67

Description (Association Association with compound (MCS)) Temperature (Association (MCS)) [°C]

-40

Partner (Association (MCS))

trimethylamine

Wheeler; Levy; Canadian Journal of Chemistry; vol. 37; (1959); p. 1727, View in Reaxys Azeotropes (MCS) (16)

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1 of 16

Temperature (Azeotropes (MCS)) [°C]

155.7

Pressure (Azeotropes (MCS)) [Torr]

1520

Concentrations (Azeotropes (MCS))

71.52

Azeotropes

pentan-1-ol

Katunina, E. P.; Marchenko, I. M.; Chervova, O. V.; Polyakova, L. V.; Garber, Yu. N.; J. Appl. Chem. USSR (Engl.

Transl.); vol. 65; nb. 9.1; (1992); p. 2028 - 2033,1653 - 1657, View in Reaxys 2 of 16

Temperature (Azeotropes (MCS)) [°C]

52.7

Pressure (Azeotropes (MCS)) [Torr]

50

Azeotropes

butan-1-ol

Katunina, E. P.; Marchenko, I. M.; Chervova, O. V.; Polyakova, L. V.; Garber, Yu. N.; J. Appl. Chem. USSR (Engl.

Transl.); vol. 65; nb. 9.1; (1992); p. 2028 - 2033,1653 - 1657, View in Reaxys 3 of 16

Temperature (Azeotropes (MCS)) [°C]

66.7

Pressure (Azeotropes (MCS)) [Torr]

100

Azeotropes

butan-1-ol

Katunina, E. P.; Marchenko, I. M.; Chervova, O. V.; Polyakova, L. V.; Garber, Yu. N.; J. Appl. Chem. USSR (Engl.

Transl.); vol. 65; nb. 9.1; (1992); p. 2028 - 2033,1653 - 1657, View in Reaxys 4 of 16

Temperature (Azeotropes (MCS)) [°C]

130.7

Pressure (Azeotropes (MCS)) [Torr]

760

Azeotropes

pentan-1-ol

Katunina, E. P.; Marchenko, I. M.; Chervova, O. V.; Polyakova, L. V.; Garber, Yu. N.; J. Appl. Chem. USSR (Engl.

Transl.); vol. 65; nb. 9.1; (1992); p. 2028 - 2033,1653 - 1657, View in Reaxys 5 of 16

Temperature (Azeotropes (MCS)) [°C]

72.7

Pressure (Azeotropes (MCS)) [Torr]

100

Azeotropes

i-Amyl alcohol

Katunina, E. P.; Marchenko, I. M.; Chervova, O. V.; Polyakova, L. V.; Garber, Yu. N.; J. Appl. Chem. USSR (Engl.

Transl.); vol. 65; nb. 9.1; (1992); p. 2028 - 2033,1653 - 1657, View in Reaxys 6 of 16

Temperature (Azeotropes (MCS)) [°C]

108.9

Pressure (Azeotropes (MCS)) [Torr]

400

Azeotropes

i-Amyl alcohol

Katunina, E. P.; Marchenko, I. M.; Chervova, O. V.; Polyakova, L. V.; Garber, Yu. N.; J. Appl. Chem. USSR (Engl.

Transl.); vol. 65; nb. 9.1; (1992); p. 2028 - 2033,1653 - 1657, View in Reaxys 7 of 16

Temperature (Azeotropes (MCS)) [°C]

128.9

Pressure (Azeotropes (MCS)) [Torr]

760

Azeotropes

i-Amyl alcohol

Katunina, E. P.; Marchenko, I. M.; Chervova, O. V.; Polyakova, L. V.; Garber, Yu. N.; J. Appl. Chem. USSR (Engl.

Transl.); vol. 65; nb. 9.1; (1992); p. 2028 - 2033,1653 - 1657, View in Reaxys

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8 of 16

Temperature (Azeotropes (MCS)) [°C]

153.4

Pressure (Azeotropes (MCS)) [Torr]

1520

Azeotropes

i-Amyl alcohol

Katunina, E. P.; Marchenko, I. M.; Chervova, O. V.; Polyakova, L. V.; Garber, Yu. N.; J. Appl. Chem. USSR (Engl.

Transl.); vol. 65; nb. 9.1; (1992); p. 2028 - 2033,1653 - 1657, View in Reaxys 9 of 16

Temperature (Azeotropes (MCS)) [°C]

130.7

Pressure (Azeotropes (MCS)) [Torr]

760

Azeotropes

pentan-1-ol

Katunina, E. P.; Marchenko, I. M.; Polyakova, L. V.; Garber, Yu. N.; Rybal'chenko, T. A.; et al.; J. Appl. Chem.

USSR (Engl. Transl.); vol. 65; nb. 11.1; (1992); p. 2485 - 2489,2051 - 2054, View in Reaxys 10 of 16

Temperature (Azeotropes (MCS)) [°C]

129

Pressure (Azeotropes (MCS)) [Torr]

760

Azeotropes

i-Amyl alcohol

Katunina, E. P.; Marchenko, I. M.; Polyakova, L. V.; Garber, Yu. N.; Rybal'chenko, T. A.; et al.; J. Appl. Chem.

USSR (Engl. Transl.); vol. 65; nb. 11.1; (1992); p. 2485 - 2489,2051 - 2054, View in Reaxys 11 of 16

Pressure (Azeotropes (MCS)) [Torr]

750

Azeotropes

(+-)-2-methyl-butan-1-ol

Patent; Stanolind Oil and Gas Co.; US2552911; (1949), View in Reaxys; Patent; Stanolind Oil and Gas Co.; US2662847; (1952), View in Reaxys; Patent; Stanolind Oil and Gas Co.; US2635072; (1950), View in Reaxys 12 of 16

Pressure (Azeotropes (MCS)) [Torr]

740

Azeotropes

H2O

Patent; Phillips Petr. Co.; US2623072; (1946), View in Reaxys 13 of 16

Azeotropes

butyl iodide

Lecat,M.; Tables azeotropiques, 2. Aufl. <Bruessel 1949>, View in Reaxys 14 of 16

Azeotropes

isopentyl alcohol

Lecat,M.; Tables azeotropiques, 2. Aufl. <Bruessel 1949>, View in Reaxys 15 of 16

Azeotropes

tetrachloroethylene

Lecat,M.; Tables azeotropiques, 2. Aufl. <Bruessel 1949>, View in Reaxys 16 of 16

Azeotropes

1-ethoxy-ethanol-(2)

Lecat,M.; Tables azeotropiques, 2. Aufl. <Bruessel 1949>, View in Reaxys Boundary Surface Phenomena (MCS) (1) 1 of 1

Description (Boundary Surface Phenomena (MCS))

Surface tension

Temperature (Boundary Surface Phenomena (MCS)) [°C]

25

Partner (Boundary Surface Phenomena (MCS))

H2O

Habrdova, Katerina; Hovorka, Stepan; Bartovska, Lidmila; Journal of Chemical and Engineering Data; vol. 49; nb. 4; (2004); p. 1003 - 1007, View in Reaxys

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Chromatographic Data (1) Chromatographic References data GC (Gas chroma- Tauber, Katharina; Fuchs, Michael; Sattler, Johann H.; Pitzer, Julia; Pressnitz, Desiree; Koszelewski, tography) Dominik; Faber, Kurt; Pfeffer, Jan; Haas, Thomas; Kroutil, Wolfgang; Chemistry - A European Journal; vol. 19; nb. 12; (2013); p. 4030 - 4035, View in Reaxys Circular Dichroism (1) References Hayward; Totty; Canadian Journal of Chemistry; vol. 49; (1971); p. 624, View in Reaxys; Barth et al.; Journal of the Chemical Society [Section] D: Chemical Communications; (1969); p. 1246, View in Reaxys; Uekama et al.; Chemistry Letters; (1977); p.

1389,1390, View in Reaxys Compressibility (1) Description (Com- Comment (Compressibility) pressibility)

References

Adiabatic compressibility

Parthasarathy; Proceedings - Indian Academy of Sciences, Section A; vol. 2; (1935); p.

508; Chem. Zentralbl.; vol. 107; nb. I; (1936); p. 1793, View in Reaxys

aus der Schallgeschwindigkeit in Cyclopentanon (1474 m/sec bei 24grad) berechnet.

Conformation (5) Object of Investi- Comment (Congation formation)

References

Conformation

Guimon et al.; Journal of Molecular Structure; vol. 33; (1976); p. 239,240,243,247, View in Reaxys; Ikeda; Lord; Journal of Chemical Physics; vol. 56; (1972); p. 4450, View in Reaxys; Geise; Mijlhoff; Recueil des Travaux Chimiques des Pays-Bas; vol. 90; (1971); p. 577, View in Reaxys; Wheeler; Granell de Rodriguez; Journal of Organic Chemistry; vol. 29; (1964); p. 718, View in Reaxys; Sablayrolles et al.; Journal de Chimie Physique et de Physico-Chimie Biologique; vol. 66; (1969); p. 1139, View in Reaxys; Batuew et al.; Bulletin of the Academy of Sciences of the USSR, Division of Chemical Science (English Translation); (1961); p. 1050; Izvestiya Akademii Nauk SSSR, Seriya Khimicheskaya; (1961); p. 1138, View in Reaxys; Ledaal; Tetrahedron Letters; (1968); p.

651, View in Reaxys; Ledaal; Tetrahedron Letters; (1967); p. 4397, View in Reaxys; Zhang, Jian; Chiang, Whe-Yi; Laane, Jaan; Journal of Chemical Physics; vol. 98; nb.

8; (1993); p. 6129 - 6137, View in Reaxys; Tamagawa, K.; Hildebrandt, R. L.; Shen, Q.; Journal of the American Chemical Society; vol. 109; nb. 5; (1987); p. 1380 - 1383, View in Reaxys; Potts, Alan R.; Nesselrodt, Dale R.; Baer, Tomas; Driscoll, Jeffrey W.; Bays, J. Philip; Journal of Physical Chemistry; vol. 99; nb. 32; (1995); p. 12090 12098, View in Reaxys

Conformer equilibrium

Reddy, B. Ananda; Rao, M. Sadasiva; Rao, N. Prabhakara; Zeitschrift fuer Physikalische Chemie (Muenchen, Germany); vol. 128; (1981); p. 57 - 62, View in Reaxys

Energy difference between the conformers

Reddy, B. Ananda; Rao, M. Sadasiva; Rao, N. Prabhakara; Zeitschrift fuer Physikalische Chemie (Muenchen, Germany); vol. 128; (1981); p. 57 - 62, View in Reaxys

Conformation

das Molekuel ist nicht planar.

Le Fevre; Le Fevre; Journal of the Chemical Society; (1956); p. 3549,3561, View in Reaxys; Batu'ew et al.; Izvestiya Akademii Nauk SSSR, Seriya Khimicheskaya; (1961); p. 1138; Chem.Abstr.; (1961); p. 27129, View in Reaxys; Brutcher et al.; Journal of the American Chemical Society; vol. 81; (1959); p. 4915,4918, View in Reaxys; Erlandsson; Journal of Chemical Physics; vol. 22; (1954); p. 563, View in Reaxys; Le Fevre et al.; Journal of the Chemical Society; (1959); p. 2340,2342, View in Reaxys

Conformation

Potentialschwelle Pitzer; Donath; Journal of the American Chemical Society; vol. 81; (1959); p. der Konformation- 3213,3215, View in Reaxys sumwandlung (Pseudorotation).

Critical Pressure (1) Critical Pressure References [Torr] 34502.8

Ambrose, D.; Ghiassee, N. B.; Journal of Chemical Thermodynamics; vol. 19; nb. 9; (1987); p. 903 - 910, View in Reaxys

Critical Temperature (1) Critical Tempera- References ture [°C]

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351.35

Ambrose, D.; Ghiassee, N. B.; Journal of Chemical Thermodynamics; vol. 19; nb. 9; (1987); p. 903 - 910, View in Reaxys

Cross-Sections (1) Description References (Cross-Sections) Collision crosssection

Christophorou; Christodoulides; Journal of Physics B: Atomic and Molecular Physics; vol. 2; (1969); p.

71,80, View in Reaxys; Christophorou; Pittman; Journal of Physics B: Atomic and Molecular Physics; vol.

3; (1970); p. 1252,1254, View in Reaxys

Crystal Phase (1) Description (Crys- Comment (Crystal References tal Phase) Phase) Crystal structure determination

.; Temperature: 298 K. Method of determination: Electron Diffraction

Crystal Property Description (2) Colour & Other Location Properties yellow colourless

Tamagawa, K.; Hildebrandt, R. L.; Shen, Q.; Journal of the American Chemical Society; vol. 109; nb. 5; (1987); p. 1380 - 1383, View in Reaxys

References Moskalenko; Belopukhov; Ivlev; Boev; Russian Journal of Organic Chemistry; vol. 47; nb. 7; (2011); p. 1091 - 1096, View in Reaxys

supporting information

Lakshmi Kantam; Arundhathi; Likhar, Pravin R.; Damodara; Advanced Synthesis and Catalysis; vol. 351; nb. 16; (2009); p. 2633 - 2637, View in Reaxys

Dielectric Constant (2) Dielectric ConFrequency (Diestant lectric Constant) [Hz]

Temperature (Die- References lectric Constant) [°C]

14.45

20

2E+06

Laurence, Christian; Nicolet, Pierre; Dalati, M. Tawfik; Abboud, Jose-Luis M.; Notario, Rafael; Journal of Physical Chemistry; vol.

98; nb. 23; (1994); p. 5807 - 5816, View in Reaxys Crossley et al.; Transactions of the Faraday Society; vol. 62; (1966); p. 576,577, View in Reaxys; Ihrig; Smith; Journal of the American Chemical Society; vol. 94; (1972); p. 34,35, View in Reaxys; Loiseleur et al.; Journal de Chimie Physique et de Physico-Chimie Biologique; vol. 64; (1967); p. 634, View in Reaxys; Pilpel; Transactions of the Faraday Society; vol. 56; (1960); p. 893,898, View in Reaxys; Grove; Walden; Journal of Chemical and Engineering Data; vol. 10; (1965); p. 98, View in Reaxys; Gallado-Herrero et al.; Comptes Rendus des Seances de l'Academie des Sciences, Serie C: Sciences Chimiques; vol. 275; (1972); p. 1319, View in Reaxys; Mayrhofer; Leiner; Tenside; vol. 4; (1967); p. 255,257, View in Reaxys

Dissociation Energy (1) Dissociation EnBond Type ergy [Jmol-1] 368438

C-H

References Bordwell; Gallagher, Timothy; Zhang, Xianman; Journal of the American Chemical Society; vol. 113; nb. 9; (1991); p. 3495 - 3497, View in Reaxys

Dissociation Exponent (11) 1 of 11

Type (Dissociation Exponent)

b1

Freiberg, W.; Roth, H.; Rautenberg, Ute; Kroeger, C.-F.; Journal fuer Praktische Chemie (Leipzig); vol. 331; nb. 3; (1989); p. 431 - 438, View in Reaxys 2 of 11

Comment (Dissociation Exponent)

(k')Basizitaetskonstante fuer die Protonierung

Mc Clelland; Reynolds; Canadian Journal of Chemistry; vol. 54; (1976); p. 718,721, 723, View in Reaxys 3 of 11

Comment (Dissociation Exponent)

(k')K(s)(φ,30grad) d. Systems mit 1-Propanol

Rao; Naidu; Journal of Chemical Thermodynamics; vol. 8; (1976); p. 73,74, 75, View in Reaxys 4 of 11

Comment (Dissociation Exponent)

(k')K(s)(φ,30grad) d. Systems mit 1-Butanol

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Rao; Naidu; Journal of Chemical Thermodynamics; vol. 8; (1976); p. 73,74, 75, View in Reaxys 5 of 11

Comment (Dissociation Exponent)

(k')K(s)(φ,30grad) d. Systems mit 1-Pentanol

Rao; Naidu; Journal of Chemical Thermodynamics; vol. 8; (1976); p. 73,74, 75, View in Reaxys 6 of 11

Comment (Dissociation Exponent)

(k')K(s)(φ,30grad) d. Systems mit 1-Hexanol

Rao; Naidu; Journal of Chemical Thermodynamics; vol. 8; (1976); p. 73,74, 75, View in Reaxys 7 of 11

Comment (Dissociation Exponent)

(pk')pK (Tab. 6)

Butler; Journal of the Chemical Society, Perkin Transactions 2: Physical Organic Chemistry (1972-1999); (1976); p.

959,960, 962, View in Reaxys 8 of 11

Comment (Dissociation Exponent)

(pk')pK(a): -7.5

Arnett et al.; Journal of the American Chemical Society; vol. 96; (1974); p. 3875,3877,3879,3883,3886, View in Reaxys 9 of 11

Comment (Dissociation Exponent)

(pk')pK(a) (Tab.1, S.1441)

Petrov; Bykova; J. Gen. Chem. USSR (Engl. Transl.); vol. 42; (1972); p. 1446,1438, View in Reaxys 10 of 11

Comment (Dissociation Exponent)

(pk')pK(BH+) (Tab.1, S.1441)

Petrov; Bykova; J. Gen. Chem. USSR (Engl. Transl.); vol. 42; (1972); p. 1446,1438, View in Reaxys 11 of 11

Comment (Dissociation Exponent)

(k')Saeuredissoziationskonstante der Ketoform pK = 16.7; Saeuredissoziationskonstante der Enolform: pK = 11.8

Bell; Smith; Journal of the Chemical Society [Section] B: Physical Organic; (1966); p. 241, View in Reaxys Dynamic Viscosity (7) Dynamic Viscosi- Temperature (Dyty [P] namic Viscosity) [°C] 0.00992

References

30

Sreenivasulu, M.; Naidu, P. R.; Indian Journal of Chemistry, Section A: Inorganic, Physical, Theoretical & Analytical; vol. 19; nb. 5; (1980); p. 470 - 471, View in Reaxys

25 - 80

Kuss; Z. ang. Phys.; vol. 7; (1955); p. 372,376, View in Reaxys

0.0049 - 0.01149

20 - 90

Kuss; Z. ang. Phys.; vol. 7; (1955); p. 372,376, View in Reaxys

0.02253

15

Timmermans; Hennaut-Roland; Journal de Chimie Physique et de Physico-Chimie Biologique; vol. 34; (1937); p. 711; Chem. Zentralbl.; vol. 109; nb. II; (1938); p. 517, View in Reaxys

0.00995

30

Timmermans; Hennaut-Roland; Journal de Chimie Physique et de Physico-Chimie Biologique; vol. 34; (1937); p. 711; Chem. Zentralbl.; vol. 109; nb. II; (1938); p. 517, View in Reaxys

0.00504 - 0.01169 20 - 90.1

Hueckel; Wunsch; Journal fuer Praktische Chemie (Leipzig); vol. <2> 142; (1935); p.

225,229, View in Reaxys

0.0107

Thole; Journal of the Chemical Society; vol. 105; (1914); p. 2011, View in Reaxys

25

Electrical Data (6) 1 of 6

Description (Electrical Data)

Dielectric loss

Crossley et al.; Transactions of the Faraday Society; vol. 62; (1966); p. 576,577, View in Reaxys 2 of 6

Description (Electrical Data)

Dielectric relaxation time

Crossley et al.; Transactions of the Faraday Society; vol. 62; (1966); p. 576,577, View in Reaxys 3 of 6

Description (Electrical Data)

Angle of dielectric loss

Jaffrain; Marin; Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences; vol. 254; (1962); p.

2958, View in Reaxys

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4 of 6

Description (Electrical Data)

Dielectric increment

Comment (Electrical Da- von in Aethanol, in 2-Methoxy-aethanol und in Aceton geloestem Cyclopentanon sowie ta) Orientierungspotential bei 25grad.

Hoigne; Gaeumann; Helvetica Chimica Acta; vol. 41; (1958); p. 1933,1949, View in Reaxys 5 of 6

Description (Electrical Data)

Dielectric relaxation time

Comment (Electrical Da- (unverd.) bei 25grad. ta) Gaeumann et al.; Helvetica Chimica Acta; vol. 39; (1956); p. 145,151, View in Reaxys 6 of 6

Description (Electrical Data)

Dielectric loss

Comment (Electrical Da- von Loesungen in Benzol. ta) Holzmueller; Phys. Z.; vol. 38; (1937); p. 574,583, View in Reaxys Electrical Moment (13) 1 of 13

Description (Electrical Moment)

Dipole moment

Moment (Electrical Moment) [D]

3.25

Pogliani, Lionello; New Journal of Chemistry; vol. 27; nb. 6; (2003); p. 919 - 927, View in Reaxys 2 of 13

Description (Electrical Moment)

Dipole moment

Tiffon; Dubois; Organic Magnetic Resonance; vol. 12; (1979); p. 24,25, View in Reaxys; Ledaal; Tetrahedron Letters; (1968); p. 651, View in Reaxys; Giavarini; Gomel; Comptes Rendus des Seances de l'Academie des Sciences, Serie C: Sciences Chimiques; vol. 267; (1968); p. 1, View in Reaxys 3 of 13

Description (Electrical Moment)

Dipole moment

Comment (Electrical Moment)

μ(0)

Gallardo-Herrero et al.; Bulletin de la Societe Chimique de France; (1973); p. 881,883, View in Reaxys 4 of 13

Description (Electrical Moment)

Dipole moment

Comment (Electrical Moment)

(ε; Cyclohexan): 2,78 D bzw. 2,87 D (S.580)

Crossley et al.; Transactions of the Faraday Society; vol. 62; (1966); p. 576,577, View in Reaxys 5 of 13

Description (Electrical Moment)

Dipole moment

Comment (Electrical Moment)

3,30 D <Stark-Effekt>

Koekeritz; Selen; Arkiv foer Fysik; vol. 16; (1960); p. 197; Chem.Abstr.; nb. 10517; (1960), View in Reaxys 6 of 13

Description (Electrical Moment)

Dipole moment

Comment (Electrical Moment)

μ = 2.86D

Pilpel; Transactions of the Faraday Society; vol. 56; (1960); p. 893,898, View in Reaxys 7 of 13

Description (Electrical Moment)

Dipole moment

Moment (Electrical Moment) [D]

3.02

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Method (Electrical Moment)

Dielectric constant (ε)

Solvent (Electrical Moment)

CCl4

Le Fevre; Le Fevre; Journal of the Chemical Society; (1956); p. 3549,3561, View in Reaxys 8 of 13

Description (Electrical Moment)

Dipole moment

Moment (Electrical Moment) [D]

2.81

Method (Electrical Moment)

Dielectric constant (ε)

Solvent (Electrical Moment)

cyclohexane

Guenthard; Gaeumann; Helvetica Chimica Acta; vol. 34; (1951); p. 39,44, View in Reaxys 9 of 13

Description (Electrical Moment)

Dipole moment

Moment (Electrical Moment) [D]

2.86

Method (Electrical Moment)

Dielectric constant (ε)

Solvent (Electrical Moment)

benzene

Guenthard; Gaeumann; Helvetica Chimica Acta; vol. 34; (1951); p. 39,44, View in Reaxys 10 of 13

Description (Electrical Moment)

Dipole moment

Moment (Electrical Moment) [D]

2.93

Method (Electrical Moment)

Dielectric constant (ε)

Solvent (Electrical Moment)

CCl4

Guenthard; Gaeumann; Helvetica Chimica Acta; vol. 34; (1951); p. 39,44, View in Reaxys 11 of 13

Description (Electrical Moment)

Dipole moment

Moment (Electrical Moment) [D]

2.93

Method (Electrical Moment)

Dielectric constant (ε)

Solvent (Electrical Moment)

benzene

Bentley et al.; Journal of the Chemical Society; (1949); p. 2957,2959, View in Reaxys 12 of 13

Description (Electrical Moment)

Dipole moment

Moment (Electrical Moment) [D]

2.98

Method (Electrical Moment)

Dielectric constant (ε)

Solvent (Electrical Moment)

benzene

Holzmueller; Phys. Z.; vol. 38; (1937); p. 574,583, View in Reaxys

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13 of 13

Description (Electrical Moment)

Dipole moment

Moment (Electrical Moment) [D]

3

Method (Electrical Moment)

Dielectric constant (ε)

Solvent (Electrical Moment)

benzene

Donle; Volkert; Zeitschrift fuer Physikalische Chemie (Leipzig); vol. <B> 8; (1930); p. 60,62, View in Reaxys Electrical Polarizability (2) Description (Elec- References trical Polarizability) Molar polarization Castagna et al.; Annales de Chimie (Cachan, France); vol. 7; nb. 14; (1972); p. 5,14, View in Reaxys Optical anisotropy Le Fevre et al.; Journal of the Chemical Society; (1959); p. 2340,2342, View in Reaxys Electrochemical Behaviour (7) Description (Elec- References trochemical Behaviour) Proton affinity

Bouchoux, Guy; Leblanc, Danielle; Mo, Otilia; Yanez, Manuel; Journal of Organic Chemistry; vol. 62; nb.

24; (1997); p. 8439 - 8441, View in Reaxys

Electrolytic dissociation / protonation equilibrium

Bordwell, Frederick G.; Harrelson, John A.; Canadian Journal of Chemistry; vol. 68; nb. 10; (1990); p.

1714 - 1718, View in Reaxys; Bordwell, Frederick G.; Fried, Herbert E.; Journal of Organic Chemistry; vol.

56; nb. 13; (1991); p. 4218 - 4223, View in Reaxys; Freiberg, W.; Roth, H.; Rautenberg, Ute; Kroeger, C.F.; Journal fuer Praktische Chemie (Leipzig); vol. 331; nb. 3; (1989); p. 431 - 438, View in Reaxys

Thermodynamic parameters for dissociation / protonation

Arnett, Edward M.; Venkatasubramaniam, K. G.; Journal of Organic Chemistry; vol. 48; nb. 10; (1983); p.

1569 - 1578, View in Reaxys; Gold, Victor; Laali, Khosrow; Morris, Kenneth P.; Zdunek, Leszek Z.; Journal of the Chemical Society, Perkin Transactions 2: Physical Organic Chemistry (1972-1999); (1985); p. 865 870, View in Reaxys

Kinetics of dissociation (electrolytic) / protonation

Gold, Victor; Laali, Khosrow; Morris, Kenneth P.; Zdunek, Leszek Z.; Journal of the Chemical Society, Perkin Transactions 2: Physical Organic Chemistry (1972-1999); (1985); p. 865 - 870, View in Reaxys

Basicity

Lemetais; Carpentier; Tetrahedron Letters; (1979); p. 569, View in Reaxys; Petrov; Bykova; J. Gen. Chem.

USSR (Engl. Transl.); vol. 42; (1972); p. 1446,1438, View in Reaxys

Polarography

Karpinets; Bezuglyi; J. Gen. Chem. USSR (Engl. Transl.); vol. 49; (1979); p. 2116,1857,1859, View in Reaxys; Albisson; Simonet; Bulletin de la Societe Chimique de France; (1971); p. 4213,4218, View in Reaxys; Kalugin et al.; J. Anal. Chem. USSR (Engl. Transl.); vol. 15; (1960); p. 739,847, View in Reaxys; Molnar et al.; Chemicke Zvesti; vol. 14; (1960); p. 783,786,787; Chem.Abstr.; vol. 55; nb.

16221; (1961), View in Reaxys

Acidity

Petrov; Bykova; J. Gen. Chem. USSR (Engl. Transl.); vol. 42; (1972); p. 1446,1438, View in Reaxys

Electrochemical Characteristics (4) 1 of 4

Description (Electrochemical Characteristics)

oxidation potential

Graser, Barbara; Strohmeier, Walter; Marcec, Radovan; Steigerwald, Hannelore; Berichte der Bunsen-Gesellschaft; vol. 85; nb. 7; (1981); p. 671 - 677, View in Reaxys 2 of 4

Description (Electrochemical Characteristics)

polarographic half-wave potential

Karpinets; Bezuglyi; J. Gen. Chem. USSR (Engl. Transl.); vol. 49; (1979); p. 2116,1857,1859, View in Reaxys 3 of 4

Description (Electrochemical Characteristics)

redox potential

Albisson et al.; Comptes Rendus des Seances de l'Academie des Sciences, Serie C: Sciences Chimiques; vol.

272; (1971); p. 646, View in Reaxys

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4 of 4

Description (Electrochemical Characteristics)

polarographic current/voltage curve

Winkel; Proske; Chemische Berichte; vol. 69; (1936); p. 693,701, View in Reaxys Electron Binding (1) Description (Elec- References tron Binding) Electron affinity

Zimmermann et al.; Journal of the American Chemical Society; vol. 100; (1978); p. 4674, View in Reaxys

Energy Barriers (1) References Carreira; Lord; Journal of Chemical Physics; vol. 51; (1969); p. 3225,3226, View in Reaxys; Sharnoff; Shain; Journal of the American Chemical Society; vol. 95; (1973); p. 6465,6466, View in Reaxys; Kim; Gwinn; Journal of Chemical Physics; vol. 51; (1969); p. 1815,1818, View in Reaxys Energy Data (MCS) (32) 1 of 32

Description (Energy Data (MCS))

Molar excess Gibbs free energy

Temperature (Energy Data (MCS)) [°C]

24.99

Comment (Energy Data (MCS))

temperature dependence

Partner (Energy Data (MCS))

1,2-dichloro-ethane

Barhala, Alexandru; Dragoescu, Dana; Teodorescu, Mariana; Wichterle, Ivan; Journal of Chemical Thermodynamics; vol. 38; nb. 5; (2006); p. 617 - 623, View in Reaxys 2 of 32

Description (Energy Data (MCS))

Molar excess Gibbs free energy

Temperature (Energy Data (MCS)) [°C]

24.99

Comment (Energy Data (MCS))

temperature dependence

Partner (Energy Data (MCS))

1,1,1- trichloroethane

Barhala, Alexandru; Dragoescu, Dana; Teodorescu, Mariana; Wichterle, Ivan; Journal of Chemical Thermodynamics; vol. 38; nb. 5; (2006); p. 617 - 623, View in Reaxys 3 of 32

Description (Energy Data (MCS))

Molar excess Gibbs free energy

Temperature (Energy Data (MCS)) [°C]

29.99

Partner (Energy Data (MCS))

1,2-dichloro-ethane

Barhala, Alexandru; Dragoescu, Dana; Teodorescu, Mariana; Wichterle, Ivan; Journal of Chemical Thermodynamics; vol. 38; nb. 5; (2006); p. 617 - 623, View in Reaxys 4 of 32

Description (Energy Data (MCS))

Molar excess Gibbs free energy

Temperature (Energy Data (MCS)) [°C]

29.99

Partner (Energy Data (MCS))

1,1,1- trichloroethane

Barhala, Alexandru; Dragoescu, Dana; Teodorescu, Mariana; Wichterle, Ivan; Journal of Chemical Thermodynamics; vol. 38; nb. 5; (2006); p. 617 - 623, View in Reaxys 5 of 32

Description (Energy Data (MCS))

Molar excess Gibbs free energy

Temperature (Energy Data (MCS)) [°C]

34.99

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Partner (Energy Data (MCS))

1,2-dichloro-ethane

Barhala, Alexandru; Dragoescu, Dana; Teodorescu, Mariana; Wichterle, Ivan; Journal of Chemical Thermodynamics; vol. 38; nb. 5; (2006); p. 617 - 623, View in Reaxys 6 of 32

Description (Energy Data (MCS))

Molar excess Gibbs free energy

Temperature (Energy Data (MCS)) [°C]

34.99

Partner (Energy Data (MCS))

1,1,1- trichloroethane

Barhala, Alexandru; Dragoescu, Dana; Teodorescu, Mariana; Wichterle, Ivan; Journal of Chemical Thermodynamics; vol. 38; nb. 5; (2006); p. 617 - 623, View in Reaxys 7 of 32

Description (Energy Data (MCS))

Molar excess Gibbs free energy

Temperature (Energy Data (MCS)) [°C]

39.99

Partner (Energy Data (MCS))

1,2-dichloro-ethane

Barhala, Alexandru; Dragoescu, Dana; Teodorescu, Mariana; Wichterle, Ivan; Journal of Chemical Thermodynamics; vol. 38; nb. 5; (2006); p. 617 - 623, View in Reaxys 8 of 32

Description (Energy Data (MCS))

Molar excess Gibbs free energy

Temperature (Energy Data (MCS)) [°C]

39.99

Partner (Energy Data (MCS))

1,1,1- trichloroethane

Barhala, Alexandru; Dragoescu, Dana; Teodorescu, Mariana; Wichterle, Ivan; Journal of Chemical Thermodynamics; vol. 38; nb. 5; (2006); p. 617 - 623, View in Reaxys 9 of 32

Description (Energy Data (MCS))

Excess thermochemical parameter

Temperature (Energy Data (MCS)) [°C]

25

Partner (Energy Data (MCS))

H2O

Roux, Alain H.; Roux-Desgranges, Genevieve; Dohnal, Vladimir; Journal of Chemical and Engineering Data; vol.

47; nb. 4; (2002); p. 954 - 959, View in Reaxys 10 of 32

Description (Energy Data (MCS))

Enthalpy of solution

Temperature (Energy Data (MCS)) [°C]

25

Partner (Energy Data (MCS))

dibutyl ether

Bernazzani; Carosi; Ceccanti; Conti; Gianni; Mollica; Tine; Lepori; Matteoli; Physical Chemistry Chemical Physics; vol. 2; nb. 21; (2000); p. 4829 - 4836, View in Reaxys 11 of 32

Description (Energy Data (MCS))

Molar excess Gibbs free energy

Temperature (Energy Data (MCS)) [°C]

25

Partner (Energy Data (MCS))

dibutyl ether

Lepori; Matteoli; Bernazzani; Ceccanti; Conti; Gianni; Mollica; Tine; Physical Chemistry Chemical Physics; vol.

2; nb. 21; (2000); p. 4837 - 4842, View in Reaxys

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12 of 32

Description (Energy Data (MCS))

Heat capacity of mixtures

Temperature (Energy Data (MCS)) [°C]

25

Comment (Energy Data (MCS))

concentration dependence

Partner (Energy Data (MCS))

H2O

Hovorka, Stipan; Roux, Alain H.; Roux-Desgranges, Genevieve; Donnal, Vladimir; Journal of Solution Chemistry; vol. 28; nb. 12; (1999); p. 1289 - 1305, View in Reaxys 13 of 32

Description (Energy Data (MCS))

Excess thermochemical parameter

Temperature (Energy Data (MCS)) [°C]

35 - 45

Partner (Energy Data (MCS))

1,1,2,2-tetrachloroethane

Chadha, Renu; Tripathi, Atri D.; Journal of Chemical & Engineering Data; vol. 40; nb. 3; (1995); p. 645 - 646, View in Reaxys 14 of 32

Description (Energy Data (MCS))

Enthalpy of solution

Partner (Energy Data (MCS))

methanol

Wiberg, Kenneth B.; Morgan, Kathleen M.; Maltz, Henry; Journal of the American Chemical Society; vol. 116; nb.

24; (1994); p. 11067 - 11077, View in Reaxys 15 of 32

Description (Energy Data (MCS))

Enthalpy of solution

Partner (Energy Data (MCS))

water

Abraham, Michael H.; Whiting, Gary S.; Fuchs, Richard; Chambers, Eric J.; Journal of the Chemical Society, Perkin Transactions 2: Physical Organic Chemistry (1972-1999); nb. 2; (1990); p. 290 - 291, View in Reaxys 16 of 32

Description (Energy Data (MCS))

Enthalpy of mixtures

Partner (Energy Data (MCS))

phenol

Jeng, Mei-Lee H.; Li, Ying-Sing; Spectrochimica Acta, Part A: Molecular and Biomolecular Spectroscopy; vol. 45; nb. 5; (1989); p. 525 - 532, View in Reaxys 17 of 32

Description (Energy Data (MCS))

Entropy of mixtures

Partner (Energy Data (MCS))

phenol

Jeng, Mei-Lee H.; Li, Ying-Sing; Spectrochimica Acta, Part A: Molecular and Biomolecular Spectroscopy; vol. 45; nb. 5; (1989); p. 525 - 532, View in Reaxys 18 of 32

Description (Energy Data (MCS))

Enthalpy of solution

Temperature (Energy Data (MCS)) [°C]

25

Partner (Energy Data (MCS))

octanol

Berti, Paolo; Cabani, Sergio; Conti, Giovanni; Mollica, Vincenzo; Journal of the Chemical Society, Faraday Transactions 1: Physical Chemistry in Condensed Phases; vol. 82; (1986); p. 2547 - 2556, View in Reaxys 19 of 32

Description (Energy Data (MCS))

Excess thermochemical parameter

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Temperature (Energy Data (MCS)) [°C]

25

Partner (Energy Data (MCS))

hexane

Marongiu, B.; Dernini, S.; Polcaro, A. M.; Journal of Chemical & Engineering Data; vol. 31; nb. 2; (1986); p. 185 189, View in Reaxys 20 of 32

Description (Energy Data (MCS))

Excess thermochemical parameter

Temperature (Energy Data (MCS)) [°C]

25

Partner (Energy Data (MCS))

n-heptane

Marongiu, B.; Dernini, S.; Polcaro, A. M.; Journal of Chemical & Engineering Data; vol. 31; nb. 2; (1986); p. 185 189, View in Reaxys 21 of 32

Description (Energy Data (MCS))

Excess thermochemical parameter

Temperature (Energy Data (MCS)) [°C]

25

Partner (Energy Data (MCS))

dodecane

Marongiu, B.; Dernini, S.; Polcaro, A. M.; Journal of Chemical & Engineering Data; vol. 31; nb. 2; (1986); p. 185 189, View in Reaxys 22 of 32

Description (Energy Data (MCS))

Excess thermochemical parameter

Temperature (Energy Data (MCS)) [°C]

25

Partner (Energy Data (MCS))

Hexadecane

Marongiu, B.; Dernini, S.; Polcaro, A. M.; Journal of Chemical & Engineering Data; vol. 31; nb. 2; (1986); p. 185 189, View in Reaxys 23 of 32

Description (Energy Data (MCS))

Excess thermochemical parameter

Temperature (Energy Data (MCS)) [°C]

25

Partner (Energy Data (MCS))

cyclohexane

Marongiu, B.; Dernini, S.; Polcaro, A. M.; Journal of Chemical & Engineering Data; vol. 31; nb. 2; (1986); p. 185 189, View in Reaxys; Polo, C.; Otin, S.; Gutierrez Losa, C.; Journal of Chemical Thermodynamics; vol. 14; nb. 4; (1982); p. 309 - 312, View in Reaxys 24 of 32

Description (Energy Data (MCS))

Excess thermochemical parameter

Temperature (Energy Data (MCS)) [°C]

25

Partner (Energy Data (MCS))

benzene

Marongiu, B.; Dernini, S.; Polcaro, A. M.; Journal of Chemical & Engineering Data; vol. 31; nb. 2; (1986); p. 185 189, View in Reaxys 25 of 32

Description (Energy Data (MCS))

Excess thermochemical parameter

Temperature (Energy Data (MCS)) [°C]

25

Partner (Energy Data (MCS))

tetrachloromethane

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Marongiu, B.; Dernini, S.; Polcaro, A. M.; Journal of Chemical & Engineering Data; vol. 31; nb. 2; (1986); p. 185 189, View in Reaxys 26 of 32

Description (Energy Data (MCS))

Excess thermochemical parameter

Temperature (Energy Data (MCS)) [°C]

25

Partner (Energy Data (MCS))

Cyclopentane

Polo, C.; Otin, S.; Gutierrez Losa, C.; Journal of Chemical Thermodynamics; vol. 14; nb. 4; (1982); p. 309 - 312, View in Reaxys 27 of 32

Description (Energy Data (MCS))

Enthalpy of solution

Meyer; Gens; Journal of Chemical Thermodynamics; vol. 11; (1979); p. 719,721, 722, View in Reaxys; Arnett et al.; Journal of the American Chemical Society; vol. 96; (1974); p. 3875,3877,3879,3883,3886, View in Reaxys; Mayer et al.; Journal of Chemical Thermodynamics; vol. 9; (1977); p. 439,441, View in Reaxys 28 of 32

Description (Energy Data (MCS))

Enthalpy of dilution

Saluja et al.; Journal of the American Chemical Society; vol. 101; (1979); p. 1958,1959,1960, View in Reaxys 29 of 32

Description (Energy Data (MCS))

Thermodynamic properties of system with

Ling et al.; Journal of Physical Chemistry; vol. 70; (1966); p. 901, View in Reaxys 30 of 32

Description (Energy Data (MCS))

Enthalpy of mixing

Temperature (Energy Data (MCS)) [°C]

20

Partner (Energy Data (MCS))

chloroform

Tamres; Searles; Journal of the American Chemical Society; vol. 81; (1959); p. 2100, View in Reaxys 31 of 32

Description (Energy Data (MCS))

Enthalpy of mixing

Temperature (Energy Data (MCS)) [°C]

20

Partner (Energy Data (MCS))

tetrachloromethane

Tamres; Searles; Journal of the American Chemical Society; vol. 81; (1959); p. 2100, View in Reaxys 32 of 32

Description (Energy Data (MCS))

Enthalpy of mixing

Temperature (Energy Data (MCS)) [°C]

28

Partner (Energy Data (MCS))

Glutaronitrile

Phibbs; Journal of Physical Chemistry; vol. 59; (1955); p. 346,249, View in Reaxys Enthalpy of Combustion (1) References Wolf; Helvetica Chimica Acta; vol. 55; (1972); p. 1446, View in Reaxys; Sellers; Sunner; Acta Chemica Scandinavica (1947-1973); vol. 16; (1962); p. 46,51, View in Reaxys Enthalpy of Formation (1) References Arnett et al.; Journal of the American Chemical Society; vol. 96; (1974); p. 3875,3877,3879,3883,3886, View in Reaxys; Karpinets; Bezuglyi; J. Gen. Chem. USSR (Engl. Transl.); vol. 49; (1979); p. 2116,1857,1859, View in Reaxys; Wolf; Helvetica Chimica Acta; vol. 55; (1972); p. 1446, View in Reaxys; Andreevskii; Rayduk; J. Appl. Chem. USSR (Engl. Transl.); vol. 49; (1976); p. 1819,1832, View in Reaxys; Sellers; Sunner; Acta Chemica Scandinavica (1947-1973); vol. 16; (1962); p. 46,51, View in Reaxys; Guthrie; Cullimore; Canadian Journal of Chemistry; vol. 57; (1979); p. 240,241, View in Reaxys

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Enthalpy of Fusion (1) Enthalpy of FuReferences sion [Jmol-1] 7745.58

Labruyere-Verhavert; Bulletin des Societes Chimiques Belges; vol. 60; (1951); p. 270,274, View in Reaxys

Enthalpy of Hydrogenation (1) References Sellers; Sunner; Acta Chemica Scandinavica (1947-1973); vol. 16; (1962); p. 46,51, View in Reaxys Enthalpy of Vaporization (2) Enthalpy of VaTemperature (Enporization thalpy of Vapori[Jmol-1] zation) [°C]

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Meyer; Holz; Journal of Chemical and Engineering Data; vol. 21; (1976); p.

274,275-278, View in Reaxys; Sellers; Sunner; Acta Chemica Scandinavica (1947-1973); vol. 16; (1962); p. 46,51, View in Reaxys 40486.3

20

Baughan et al.; Proceedings of the Royal Society of London, Series A: Mathematical, Physical and Engineering Sciences; vol. 225; (1954); p. 478,502, View in Reaxys

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Kraus et al.; Comptes Rendus des Seances de l'Academie des Sciences, Serie C: Sciences Chimiques; vol.

288; (1979); p. 9,10, View in Reaxys

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Blair et al.; Journal of the Chemical Society, Chemical Communications; (1979); p. 230, View in Reaxys

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Lochmann et al.; Journal of Organometallic Chemistry; vol. 156; (1978); p. 307,308,312, View in Reaxys

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Muller; Journal of Magnetic Resonance (1969-1992); vol. 25; (1977); p. 111,118, View in Reaxys

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Kirk; Journal of the Chemical Society, Perkin Transactions 1: Organic and Bio-Organic Chemistry (1972-1999); (1977); p. 2122,2129, View in Reaxys

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Linder et al.; Journal of the American Chemical Society; vol. 99; (1977); p. 727,733, View in Reaxys

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Meyyappan; Shanmugasudaram; Zeitschrift fuer Physikalische Chemie (Leipzig); vol. 258; (1977); p. 673, View in Reaxys

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Abboud et al.; Journal of the American Chemical Society; vol. 99; (1977); p. 8325, View in Reaxys

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Guyon; Villa; Bulletin de la Societe Chimique de France; (1977); p. 145,146, 148, View in Reaxys

Further information

Kamlet,M.J. et al.; Journal of the American Chemical Society; vol. 99; (1977); p. 6027 - 6038, View in Reaxys

Further information

Kociolek,K.; Leplawy,M.; Roczniki Chemii; vol. 49; (1975); p. 1841 - 1851, View in Reaxys

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Weinmann; Roche; Journal de Chimie Physique et de Physico-Chimie Biologique; vol. 72; (1975); p. 972, View in Reaxys

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Hayward; Chemical Physics Letters; vol. 33; (1975); p. 53,54, View in Reaxys

Further information

Loper; Lee; Journal of Chemical Physics; vol. 63; (1975); p. 5509, View in Reaxys

Further information

Bain; Frost; Canadian Journal of Chemistry; vol. 51; (1973); p. 1245, View in Reaxys

Further information

Castan et al.; Journal de Chimie Physique et de Physico-Chimie Biologique; vol. 70; (1973); p. 1162, View in Reaxys

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Fratiello et al.; Journal of Organic Chemistry; vol. 38; (1973); p. 2309,2310, View in Reaxys

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Further information

Cataliotti; Paliani; Chemical Physics Letters; vol. 20; (1973); p. 280, View in Reaxys

Further information

Shain; Sharnoff; Chemical Physics Letters; vol. 17; (1972); p. 95, View in Reaxys

Further information

Shain; Sharnoff; Chemical Physics Letters; vol. 16; (1972); p. 503, View in Reaxys

Further information

Shain et al.; Chemical Physics Letters; vol. 16; (1972); p. 206, View in Reaxys

Further information

Howard-Lock; King; Journal of Molecular Spectroscopy; vol. 36; (1970); p. 53,54-76, View in Reaxys

Further information

Winde; Zeitschrift fuer Physikalische Chemie (Leipzig); vol. 245; (1970); p. 401, View in Reaxys

Further information

Chandler; Goodman; Journal of Molecular Spectroscopy; vol. 35; (1970); p. 232,236, View in Reaxys

Further information

Sharnoff; Molecular Crystals and Liquid Crystals (1969-1991); vol. 9; (1969); p. 265,276,277,278,281, View in Reaxys

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Brower et al.; Journal of Physical Chemistry; vol. 73; (1969); p. 207, View in Reaxys

Further information

Axelrod et al.; Tetrahedron Letters; (1969); p. 5031, View in Reaxys

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Lynch et al.; Journal of Physical Chemistry; vol. 73; (1969); p. 3273, View in Reaxys

Further information

Geneste et al.; Comptes Rendus des Seances de l'Academie des Sciences, Serie C: Sciences Chimiques; vol. 269; (1969); p. 1012, View in Reaxys

Further information

Kim; Gwinn; Journal of Chemical Physics; vol. 51; (1969); p. 1815,1818, View in Reaxys

Further information

Liberman; Vasina; Bulletin of the Academy of Sciences of the USSR, Division of Chemical Science (English Translation); (1968); p. 609,610,611; Izvestiya Akademii Nauk SSSR, Seriya Khimicheskaya; (1968); p. 632, View in Reaxys

Further information

Toda; Akagi; Tetrahedron Letters; (1968); p. 3695, View in Reaxys

Further information

Giavarini; Gomel; Comptes Rendus des Seances de l'Academie des Sciences, Serie C: Sciences Chimiques; vol. 267; (1968); p. 1, View in Reaxys

Further information

Mayrhofer; Leiner; Tenside; vol. 4; (1967); p. 255,257, View in Reaxys

Further information

Jakerson et al.; Bulletin of the Academy of Sciences of the USSR, Division of Chemical Science (English Translation); (1966); p. 1868,1869; Izvestiya Akademii Nauk SSSR, Seriya Khimicheskaya; (1966); p. 1931, View in Reaxys

Further information

Weimer; Prausnitz; Spectrochimica Acta; vol. 22; (1966); p. 77,79, View in Reaxys

Further information

Walsh; Kuivila; Journal of the American Chemical Society; vol. 88; (1966); p. 576,578, View in Reaxys

Further information

Bhaskar et al.; Transactions of the Faraday Society; vol. 62; (1966); p. 788,791, View in Reaxys

Further information

Brandsma,L. et al.; Recueil des Travaux Chimiques des Pays-Bas; vol. 84; (1965); p. 560 - 566, View in Reaxys

Further information

Savatsky et al.; Journal of Physical Chemistry; vol. 69; (1965); p. 3105, View in Reaxys

Further information

Loiseleur et al.; Journal de Chimie Physique et de Physico-Chimie Biologique; vol. 62; (1965); p.

1380,1382, View in Reaxys

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Aplin et al.; Journal of the American Chemical Society; vol. 87; (1965); p. 3180,3182, View in Reaxys

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Further information

Wobschall; Norton; Journal of the American Chemical Society; vol. 87; (1965); p. 3559,3561, View in Reaxys

Further information

Loiseleur et al.; Journal de Chimie Physique et de Physico-Chimie Biologique; vol. 61; (1964); p.

1231,1232,1233, View in Reaxys

Further information

Patent; Allied Chem.; NL6402964; (1964); Chem.Abstr.; vol. 62; nb. 7658; (1965), View in Reaxys

Further information

Bellamy; Pace; Spectrochimica Acta; vol. 19; (1963); p. 1831,1834, View in Reaxys

Further information

Feather; Gold; Proceedings of the Chemical Society, London; (1963); p. 306, View in Reaxys

Further information

Michel; Bulletin des Societes Chimiques Belges; vol. 72; (1963); p. 138, View in Reaxys

Further information

Fal'kowskii et al.; J. Appl. Chem. USSR (Engl. Transl.); vol. 36; (1963); p. 230,218, View in Reaxys

Further information

Foster; Mackie; Tetrahedron; vol. 18; (1962); p. 1131,1134, View in Reaxys

Further information

Watanabe et al.; Journal of Quantitative Spectroscopy and Radiative Transfer; vol. 2; (1962); p. 369,377, View in Reaxys

Further information

Sellers; Sunner; Acta Chemica Scandinavica (1947-1973); vol. 16; (1962); p. 46,51, View in Reaxys

Further information

HERMANEK; SCHWARZ; CEKAN; Die Pharmazie; vol. 16; (1961); p. 566 - 569, View in Reaxys

Further information

Batuew et al.; Bulletin of the Academy of Sciences of the USSR, Division of Chemical Science (English Translation); (1961); p. 1050; Izvestiya Akademii Nauk SSSR, Seriya Khimicheskaya; (1961); p. 1138, View in Reaxys

Further information

Treibs; Naturwissenschaften; vol. 47; (1960); p. 179, View in Reaxys

Further information

Zbinden; Hall; Journal of the American Chemical Society; vol. 82; (1960); p. 1215, View in Reaxys

Further information

Mountcastle et al.; Journal of Physical Chemistry; vol. 64; (1960); p. 1342, View in Reaxys

Further information

Vilesov; Doklady Physical Chemistry; vol. 130-135; (1960); p. 521; Doklady Akademii Nauk SSSR; vol. 132; (1960); p. 1332, View in Reaxys

Further information

Buerer; Guenthard; Helvetica Chimica Acta; vol. 43; (1960); p. 1487,1489, View in Reaxys

Further information

Beynon et al.; Applied Spectroscopy; vol. 14; (1960); p. 95,96,97; Chem.Abstr.; nb. 20464; (1960), View in Reaxys

Heat Capacity Cp (3) Heat Capacity Cp Temperature [Jmol-1K-1] (Heat Capacity Cp) [°C]

References

152.7

25

Hovorka, Stipan; Roux, Alain H.; Roux-Desgranges, Genevieve; Donnal, Vladimir; Journal of Solution Chemistry; vol. 28; nb. 12; (1999); p. 1289 - 1305, View in Reaxys

154.5

25.1

Fuchs, Richard; Canadian Journal of Chemistry; vol. 58; nb. 22; (1980); p. 2305 - 2306, View in Reaxys Andreevskii; Rayduk; J. Appl. Chem. USSR (Engl. Transl.); vol. 49; (1976); p.

1819,1832, View in Reaxys

Henry Constant (MCS) (1) 1 of 1

Comment (Henry Constant (MCS))

Henry constant given

O'Farrell, Christina E.; Waghorne, W. Earle; Journal of Chemical and Engineering Data; vol. 55; nb. 4; (2010); p.

1655 - 1658, View in Reaxys Interatomic Distances and Angles (1) Description References

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Interatomic distances and angles

Kim; Gwinn; Journal of Chemical Physics; vol. 51; (1969); p. 1815,1818, View in Reaxys; Tamagawa, K.; Hildebrandt, R. L.; Shen, Q.; Journal of the American Chemical Society; vol. 109; nb. 5; (1987); p. 1380 1383, View in Reaxys

Ionization Potential (3) Ionization Poten- Method (Ionizatial [eV] tion Potential)

References

9.27

spectrographical

O'Toole, Liam; Brint, Paul; Kosmidis, Constantine; Boulakis, George; Tsekeris, Pericles; Journal of the Chemical Society, Faraday Transactions; vol. 87; nb. 20; (1991); p. 3343 - 3352, View in Reaxys; O'Toole, Liam; Brint, Paul; Kosmidis, Constantine; Boulakis, George; Bolovinos, Agisilaos; Journal of the Chemical Society, Faraday Transactions; vol. 88; nb. 9; (1992); p. 1237 - 1244, View in Reaxys

9.3

Photoionization

Sandorfy, Camille; Lewis, Jerry W.; Wladislaw, Blanka; Calegao, Isabel C. C.; Phosphorus and Sulfur and the Related Elements; vol. 16; (1983); p. 287 - 292, View in Reaxys Gerson et al.; Journal of Electron Spectroscopy and Related Phenomena; vol. 13; (1978); p. 421,423,424, View in Reaxys; Bain; Frost; Canadian Journal of Chemistry; vol. 51; (1973); p. 1245, View in Reaxys; Watanabe et al.; Journal of Quantitative Spectroscopy and Radiative Transfer; vol. 2; (1962); p. 369,377, View in Reaxys; Vilesov; Doklady Physical Chemistry; vol. 130-135; (1960); p. 521; Doklady Akademii Nauk SSSR; vol. 132; (1960); p. 1332, View in Reaxys; Cocksey et al.; Journal of the Chemical Society [Section] B: Physical Organic; (1971); p. 790, View in Reaxys; Blair et al.; Journal of the Chemical Society, Chemical Communications; (1979); p. 230, View in Reaxys; Chadwick et al.; Tetrahedron Letters; (1971); p. 4543, View in Reaxys

Liquid/Liquid Systems (MCS) (11) 1 of 11

Description (Liquid/ Liquid Systems (MCS))

Distribution between solvent 1 + 2

Temperature (Liquid/ Liquid Systems (MCS)) [°C]

69.99 - 109.99

Partner (Liquid/Liquid Systems (MCS))

1-Hexadecanol; air

Xiao, Hang; Lei, Ying Duan; Wania, Frank; Journal of Chemical and Engineering Data; vol. 51; nb. 2; (2006); p.

338 - 346, View in Reaxys 2 of 11

Description (Liquid/ Liquid Systems (MCS))

Distribution between solvent 1 + 2

Temperature (Liquid/ Liquid Systems (MCS)) [°C]

20

Partner (Liquid/Liquid Systems (MCS))

octanol

Leshchev; Russian Journal of Physical Chemistry A; vol. 76; nb. 10; (2002); p. 1597 - 1603, View in Reaxys 3 of 11

Description (Liquid/ Liquid Systems (MCS))

Distribution between solvent 1 + 2

Solvent (Liquid/Liquid Systems (MCS))

gas

Temperature (Liquid/ Liquid Systems (MCS)) [°C]

39.2

Partner (Liquid/Liquid Systems (MCS))

apolane

Weckwerth, Jeff D.; Carr, Peter W.; Vitha, Mark F.; Nasehzadeh, Asad; Analytical Chemistry; vol. 70; nb. 17; (1998); p. 3712 - 3716, View in Reaxys 4 of 11

Description (Liquid/ Liquid Systems (MCS))

Distribution between solvent 1 + 2

Partner (Liquid/Liquid Systems (MCS))

Hexadecane; water

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Abraham, Michael H.; Whiting, Gary S.; Fuchs, Richard; Chambers, Eric J.; Journal of the Chemical Society, Perkin Transactions 2: Physical Organic Chemistry (1972-1999); nb. 2; (1990); p. 290 - 291, View in Reaxys 5 of 11

Description (Liquid/ Liquid Systems (MCS))

Distribution between solvent 1 + 2

Solvent (Liquid/Liquid Systems (MCS))

H2O

Temperature (Liquid/ Liquid Systems (MCS)) [°C]

25

Partner (Liquid/Liquid Systems (MCS))

octanol

Leahy; Journal of pharmaceutical sciences; vol. 75; nb. 7; (1986); p. 629 - 636, View in Reaxys 6 of 11

Description (Liquid/ Liquid Systems (MCS))

Distribution between solvent 1 + 2

Solvent (Liquid/Liquid Systems (MCS))

H2O

Temperature (Liquid/ Liquid Systems (MCS)) [°C]

25

Partner (Liquid/Liquid Systems (MCS))

gas

Kamlet; Doherty; Abboud; Abraham; Taft; Journal of Pharmaceutical Sciences; vol. 75; nb. 4; (1986); p. 338 349, View in Reaxys 7 of 11

Description (Liquid/ Liquid Systems (MCS))

Liquid/liquid phase diagram

Rosso; Carbonnel; Bulletin de la Societe Chimique de France; vol. #; (1978); p. 381,383, View in Reaxys 8 of 11

Description (Liquid/ Liquid Systems (MCS))

Solution equilibrium

Wolski; Roczniki Chemii; vol. 44; (1970); p. 2237, View in Reaxys 9 of 11

Description (Liquid/ Liquid Systems (MCS))

Distribution between solvent 1 + 2

Beroza; Bowman; Analytical Chemistry; vol. 38; (1966); p. 1544,1547, View in Reaxys 10 of 11

Description (Liquid/ Liquid Systems (MCS))

Solution equilibrium

Partner (Liquid/Liquid Systems (MCS))

water

Bertini; Pino; Chimica e l'Industria (Milan, Italy); vol. 41; (1959); p. 195, View in Reaxys 11 of 11

Description (Liquid/ Liquid Systems (MCS))

Solution equilibrium

Partner (Liquid/Liquid Systems (MCS))

water; succinic acid

Bertini; Pino; Chimica e l'Industria (Milan, Italy); vol. 41; (1959); p. 195, View in Reaxys Liquid/Solid Systems (MCS) (3) 1 of 3

Description (Liquid/Solid Liquid/solid phase diagram Systems (MCS)) Temperature (Liquid/ Solid Systems (MCS)) [°C]

-58.4 - -22.8

Partner (Liquid/Solid Systems (MCS))

tetrachloromethane

Guanquan, Che; Ott, J. Bevan; Goates, J. Rex; Journal of Chemical Thermodynamics; vol. 18; nb. 4; (1986); p.

323 - 330, View in Reaxys

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2 of 3

Description (Liquid/Solid Eutectic Systems (MCS)) Partner (Liquid/Solid Systems (MCS))

tetrachloromethane

Guanquan, Che; Ott, J. Bevan; Goates, J. Rex; Journal of Chemical Thermodynamics; vol. 18; nb. 4; (1986); p.

323 - 330, View in Reaxys 3 of 3

Description (Liquid/Solid Melting diagram Systems (MCS)) Partner (Liquid/Solid Systems (MCS))

tetrachloromethane

Guanquan, Che; Ott, J. Bevan; Goates, J. Rex; Journal of Chemical Thermodynamics; vol. 18; nb. 4; (1986); p.

323 - 330, View in Reaxys Liquid/Vapour Systems (MCS) (40) 1 of 40

Description (Liquid/ Vapour pressure diagram for the mixture Vapour Systems (MCS)) Temperature (Liquid/ 24.99 Vapour Systems (MCS)) [°C] Comment (Liquid/ temperature dependence Vapour Systems (MCS)) Partner (Liquid/Vapour Systems (MCS))

1,2-dichloro-ethane

Barhala, Alexandru; Dragoescu, Dana; Teodorescu, Mariana; Wichterle, Ivan; Journal of Chemical Thermodynamics; vol. 38; nb. 5; (2006); p. 617 - 623, View in Reaxys 2 of 40

Description (Liquid/ Vapour pressure diagram for the mixture Vapour Systems (MCS)) Temperature (Liquid/ 24.99 Vapour Systems (MCS)) [°C] Comment (Liquid/ temperature dependence Vapour Systems (MCS)) Partner (Liquid/Vapour Systems (MCS))

1,1,1- trichloroethane

Barhala, Alexandru; Dragoescu, Dana; Teodorescu, Mariana; Wichterle, Ivan; Journal of Chemical Thermodynamics; vol. 38; nb. 5; (2006); p. 617 - 623, View in Reaxys 3 of 40

Description (Liquid/ Vapour pressure diagram for the mixture Vapour Systems (MCS)) Temperature (Liquid/ 29.99 Vapour Systems (MCS)) [°C] Partner (Liquid/Vapour Systems (MCS))

1,2-dichloro-ethane

Barhala, Alexandru; Dragoescu, Dana; Teodorescu, Mariana; Wichterle, Ivan; Journal of Chemical Thermodynamics; vol. 38; nb. 5; (2006); p. 617 - 623, View in Reaxys 4 of 40

Description (Liquid/ Vapour pressure diagram for the mixture Vapour Systems (MCS)) Temperature (Liquid/ 29.99 Vapour Systems (MCS)) [°C] Partner (Liquid/Vapour Systems (MCS))

1,1,1- trichloroethane

Barhala, Alexandru; Dragoescu, Dana; Teodorescu, Mariana; Wichterle, Ivan; Journal of Chemical Thermodynamics; vol. 38; nb. 5; (2006); p. 617 - 623, View in Reaxys

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5 of 40

Description (Liquid/ Vapour pressure diagram for the mixture Vapour Systems (MCS)) Temperature (Liquid/ 34.99 Vapour Systems (MCS)) [°C] Partner (Liquid/Vapour Systems (MCS))

1,2-dichloro-ethane

Barhala, Alexandru; Dragoescu, Dana; Teodorescu, Mariana; Wichterle, Ivan; Journal of Chemical Thermodynamics; vol. 38; nb. 5; (2006); p. 617 - 623, View in Reaxys 6 of 40

Description (Liquid/ Vapour pressure diagram for the mixture Vapour Systems (MCS)) Temperature (Liquid/ 34.99 Vapour Systems (MCS)) [°C] Partner (Liquid/Vapour Systems (MCS))

1,1,1- trichloroethane

Barhala, Alexandru; Dragoescu, Dana; Teodorescu, Mariana; Wichterle, Ivan; Journal of Chemical Thermodynamics; vol. 38; nb. 5; (2006); p. 617 - 623, View in Reaxys 7 of 40

Description (Liquid/ Vapour pressure diagram for the mixture Vapour Systems (MCS)) Temperature (Liquid/ 39.99 Vapour Systems (MCS)) [°C] Partner (Liquid/Vapour Systems (MCS))

1,2-dichloro-ethane

Barhala, Alexandru; Dragoescu, Dana; Teodorescu, Mariana; Wichterle, Ivan; Journal of Chemical Thermodynamics; vol. 38; nb. 5; (2006); p. 617 - 623, View in Reaxys 8 of 40

Description (Liquid/ Vapour pressure diagram for the mixture Vapour Systems (MCS)) Temperature (Liquid/ 39.99 Vapour Systems (MCS)) [°C] Partner (Liquid/Vapour Systems (MCS))

1,1,1- trichloroethane

Barhala, Alexandru; Dragoescu, Dana; Teodorescu, Mariana; Wichterle, Ivan; Journal of Chemical Thermodynamics; vol. 38; nb. 5; (2006); p. 617 - 623, View in Reaxys 9 of 40

Description (Liquid/ Liquid/vapour equilibrium Vapour Systems (MCS)) Temperature (Liquid/ 25 Vapour Systems (MCS)) [°C] Partner (Liquid/Vapour Systems (MCS))

dibutyl ether

Lepori; Matteoli; Bernazzani; Ceccanti; Conti; Gianni; Mollica; Tine; Physical Chemistry Chemical Physics; vol.

2; nb. 21; (2000); p. 4837 - 4842, View in Reaxys 10 of 40

Description (Liquid/ Activity coefficients of the components in the mixture Vapour Systems (MCS)) Temperature (Liquid/ 25 Vapour Systems (MCS)) [°C] Partner (Liquid/Vapour Systems (MCS))

Hexadecane

Dallas, Andrew J.; Carr, Peter W.; Journal of Physical Chemistry; vol. 98; nb. 18; (1994); p. 4927 - 4939, View in Reaxys

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11 of 40

Description (Liquid/ Activity coefficients of the components in the mixture Vapour Systems (MCS)) Temperature (Liquid/ 129 - 130.3 Vapour Systems (MCS)) [°C] Partner (Liquid/Vapour Systems (MCS))

i-Amyl alcohol

Katunina, E. P.; Marchenko, I. M.; Chervova, O. V.; Polyakova, L. V.; Garber, Yu. N.; J. Appl. Chem. USSR (Engl.

Transl.); vol. 65; nb. 9.1; (1992); p. 2028 - 2033,1653 - 1657, View in Reaxys 12 of 40

Description (Liquid/ Liquid/vapour equilibrium Vapour Systems (MCS)) Temperature (Liquid/ 129 - 130.3 Vapour Systems (MCS)) [°C] Partner (Liquid/Vapour Systems (MCS))

i-Amyl alcohol

Katunina, E. P.; Marchenko, I. M.; Chervova, O. V.; Polyakova, L. V.; Garber, Yu. N.; J. Appl. Chem. USSR (Engl.

Transl.); vol. 65; nb. 9.1; (1992); p. 2028 - 2033,1653 - 1657, View in Reaxys 13 of 40

Description (Liquid/ Activity coefficients of the components in the mixture Vapour Systems (MCS)) Temperature (Liquid/ 130 - 135.7 Vapour Systems (MCS)) [°C] Partner (Liquid/Vapour Systems (MCS))

pentan-1-ol

Katunina, E. P.; Marchenko, I. M.; Chervova, O. V.; Polyakova, L. V.; Garber, Yu. N.; J. Appl. Chem. USSR (Engl.

Transl.); vol. 65; nb. 9.1; (1992); p. 2028 - 2033,1653 - 1657, View in Reaxys 14 of 40

Description (Liquid/ Liquid/vapour equilibrium Vapour Systems (MCS)) Temperature (Liquid/ 130 - 135.7 Vapour Systems (MCS)) [°C] Partner (Liquid/Vapour Systems (MCS))

pentan-1-ol

Katunina, E. P.; Marchenko, I. M.; Chervova, O. V.; Polyakova, L. V.; Garber, Yu. N.; J. Appl. Chem. USSR (Engl.

Transl.); vol. 65; nb. 9.1; (1992); p. 2028 - 2033,1653 - 1657, View in Reaxys 15 of 40

Description (Liquid/ Activity coefficients of the components in the mixture Vapour Systems (MCS)) Temperature (Liquid/ 132.4 - 152 Vapour Systems (MCS)) [°C] Partner (Liquid/Vapour Systems (MCS))

cyclohexanone

Katunina, E. P.; Marchenko, I. M.; Chervova, O. V.; Polyakova, L. V.; Garber, Yu. N.; J. Appl. Chem. USSR (Engl.

Transl.); vol. 65; nb. 9.1; (1992); p. 2028 - 2033,1653 - 1657, View in Reaxys 16 of 40

Description (Liquid/ Liquid/vapour equilibrium Vapour Systems (MCS)) Temperature (Liquid/ 132.4 - 152 Vapour Systems (MCS)) [°C] Partner (Liquid/Vapour Systems (MCS))

cyclohexanone

Katunina, E. P.; Marchenko, I. M.; Chervova, O. V.; Polyakova, L. V.; Garber, Yu. N.; J. Appl. Chem. USSR (Engl.

Transl.); vol. 65; nb. 9.1; (1992); p. 2028 - 2033,1653 - 1657, View in Reaxys

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17 of 40

Description (Liquid/ Activity coefficients of the components in the mixture Vapour Systems (MCS)) Temperature (Liquid/ 131.4 - 157 Vapour Systems (MCS)) [°C] Partner (Liquid/Vapour Systems (MCS))

cyclohexanol

Katunina, E. P.; Marchenko, I. M.; Chervova, O. V.; Polyakova, L. V.; Garber, Yu. N.; J. Appl. Chem. USSR (Engl.

Transl.); vol. 65; nb. 9.1; (1992); p. 2028 - 2033,1653 - 1657, View in Reaxys 18 of 40

Description (Liquid/ Liquid/vapour equilibrium Vapour Systems (MCS)) Temperature (Liquid/ 131.4 - 157 Vapour Systems (MCS)) [°C] Partner (Liquid/Vapour Systems (MCS))

cyclohexanol

Katunina, E. P.; Marchenko, I. M.; Chervova, O. V.; Polyakova, L. V.; Garber, Yu. N.; J. Appl. Chem. USSR (Engl.

Transl.); vol. 65; nb. 9.1; (1992); p. 2028 - 2033,1653 - 1657, View in Reaxys 19 of 40

Description (Liquid/ Liquid/vapour equilibrium Vapour Systems (MCS)) Temperature (Liquid/ 117.5 - 127.2 Vapour Systems (MCS)) [°C] Partner (Liquid/Vapour Systems (MCS))

butan-1-ol

Katunina, E. P.; Marchenko, I. M.; Chervova, O. V.; Polyakova, L. V.; Garber, Yu. N.; J. Appl. Chem. USSR (Engl.

Transl.); vol. 65; nb. 9.1; (1992); p. 2028 - 2033,1653 - 1657, View in Reaxys 20 of 40

Description (Liquid/ Activity coefficients of the components in the mixture Vapour Systems (MCS)) Temperature (Liquid/ 117.5 - 127.2 Vapour Systems (MCS)) [°C] Partner (Liquid/Vapour Systems (MCS))

butan-1-ol

Katunina, E. P.; Marchenko, I. M.; Chervova, O. V.; Polyakova, L. V.; Garber, Yu. N.; J. Appl. Chem. USSR (Engl.

Transl.); vol. 65; nb. 9.1; (1992); p. 2028 - 2033,1653 - 1657, View in Reaxys 21 of 40

Description (Liquid/ Liquid/vapour equilibrium Vapour Systems (MCS)) Temperature (Liquid/ 131.3 - 136.4 Vapour Systems (MCS)) [°C] Pressure (Liquid/Vapour 760 Systems (MCS)) [Torr] Partner (Liquid/Vapour Systems (MCS))

i-Amyl alcohol; pentan-1-ol

Katunina, E. P.; Marchenko, I. M.; Polyakova, L. V.; Garber, Yu. N.; Rybal'chenko, T. A.; et al.; J. Appl. Chem.

USSR (Engl. Transl.); vol. 65; nb. 11.1; (1992); p. 2485 - 2489,2051 - 2054, View in Reaxys 22 of 40

Description (Liquid/ Boiling points of mixtures Vapour Systems (MCS)) Temperature (Liquid/ 131.3 - 136.5 Vapour Systems (MCS)) [°C] Pressure (Liquid/Vapour 760 Systems (MCS)) [Torr]

Copyright © 2017 Reed Elsevier Properties SA. All rights reserved. Authorized use only. Reaxys® and the Reaxys® trademark are owned and protected by Reed Elsevier Properties SA and used under license.

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Partner (Liquid/Vapour Systems (MCS))

i-Amyl alcohol; pentan-1-ol

Katunina, E. P.; Marchenko, I. M.; Polyakova, L. V.; Garber, Yu. N.; Rybal'chenko, T. A.; et al.; J. Appl. Chem.

USSR (Engl. Transl.); vol. 65; nb. 11.1; (1992); p. 2485 - 2489,2051 - 2054, View in Reaxys 23 of 40

Description (Liquid/ Liquid/vapour phase diagram Vapour Systems (MCS)) Pressure (Liquid/Vapour 760 Systems (MCS)) [Torr] Partner (Liquid/Vapour Systems (MCS))

i-Amyl alcohol; pentan-1-ol

Katunina, E. P.; Marchenko, I. M.; Polyakova, L. V.; Garber, Yu. N.; Rybal'chenko, T. A.; et al.; J. Appl. Chem.

USSR (Engl. Transl.); vol. 65; nb. 11.1; (1992); p. 2485 - 2489,2051 - 2054, View in Reaxys 24 of 40

Description (Liquid/ Liquid/vapour phase diagram Vapour Systems (MCS)) Pressure (Liquid/Vapour 760 Systems (MCS)) [Torr] Partner (Liquid/Vapour Systems (MCS))

i-Amyl alcohol; cyclohexanone

Katunina, E. P.; Marchenko, I. M.; Polyakova, L. V.; Garber, Yu. N.; Rybal'chenko, T. A.; et al.; J. Appl. Chem.

USSR (Engl. Transl.); vol. 65; nb. 11.1; (1992); p. 2485 - 2489,2051 - 2054, View in Reaxys 25 of 40

Description (Liquid/ Liquid/vapour equilibrium Vapour Systems (MCS)) Temperature (Liquid/ 120.9 - 129.5 Vapour Systems (MCS)) [°C] Pressure (Liquid/Vapour 760 Systems (MCS)) [Torr] Partner (Liquid/Vapour Systems (MCS))

butan-1-ol; i-Amyl alcohol

Katunina, E. P.; Marchenko, I. M.; Polyakova, L. V.; Garber, Yu. N.; Rybal'chenko, T. A.; et al.; J. Appl. Chem.

USSR (Engl. Transl.); vol. 65; nb. 11.1; (1992); p. 2485 - 2489,2051 - 2054, View in Reaxys 26 of 40

Description (Liquid/ Boiling points of mixtures Vapour Systems (MCS)) Temperature (Liquid/ 120.9 - 129.5 Vapour Systems (MCS)) [°C] Pressure (Liquid/Vapour 760 Systems (MCS)) [Torr] Partner (Liquid/Vapour Systems (MCS))

butan-1-ol; i-Amyl alcohol

Katunina, E. P.; Marchenko, I. M.; Polyakova, L. V.; Garber, Yu. N.; Rybal'chenko, T. A.; et al.; J. Appl. Chem.

USSR (Engl. Transl.); vol. 65; nb. 11.1; (1992); p. 2485 - 2489,2051 - 2054, View in Reaxys 27 of 40

Description (Liquid/ Liquid/vapour phase diagram Vapour Systems (MCS)) Pressure (Liquid/Vapour 760 Systems (MCS)) [Torr] Partner (Liquid/Vapour Systems (MCS))

butan-1-ol; i-Amyl alcohol

Katunina, E. P.; Marchenko, I. M.; Polyakova, L. V.; Garber, Yu. N.; Rybal'chenko, T. A.; et al.; J. Appl. Chem.

USSR (Engl. Transl.); vol. 65; nb. 11.1; (1992); p. 2485 - 2489,2051 - 2054, View in Reaxys 28 of 40

Description (Liquid/ Liquid/vapour equilibrium Vapour Systems (MCS))

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Temperature (Liquid/ 25 Vapour Systems (MCS)) [°C] Partner (Liquid/Vapour Systems (MCS))

n-heptane

Matteoli, Enrico; Lepori, Luciano; Journal of Chemical & Engineering Data; vol. 33; nb. 3; (1988); p. 247 - 250, View in Reaxys 29 of 40

Description (Liquid/ Activity coefficients of the components in the mixture Vapour Systems (MCS)) Temperature (Liquid/ 25 Vapour Systems (MCS)) [°C] Partner (Liquid/Vapour Systems (MCS))

n-heptane

Matteoli, Enrico; Lepori, Luciano; Journal of Chemical & Engineering Data; vol. 33; nb. 3; (1988); p. 247 - 250, View in Reaxys 30 of 40

Description (Liquid/ Liquid/vapour equilibrium Vapour Systems (MCS)) Temperature (Liquid/ 25 Vapour Systems (MCS)) [°C] Partner (Liquid/Vapour Systems (MCS))

cyclohexane

Matteoli, Enrico; Lepori, Luciano; Journal of Chemical & Engineering Data; vol. 33; nb. 3; (1988); p. 247 - 250, View in Reaxys 31 of 40

Description (Liquid/ Activity coefficients of the components in the mixture Vapour Systems (MCS)) Temperature (Liquid/ 25 Vapour Systems (MCS)) [°C] Partner (Liquid/Vapour Systems (MCS))

cyclohexane

Matteoli, Enrico; Lepori, Luciano; Journal of Chemical & Engineering Data; vol. 33; nb. 3; (1988); p. 247 - 250, View in Reaxys 32 of 40

Description (Liquid/ Liquid/vapour equilibrium Vapour Systems (MCS)) Temperature (Liquid/ 25 Vapour Systems (MCS)) [°C] Partner (Liquid/Vapour Systems (MCS))

benzene

Matteoli, Enrico; Lepori, Luciano; Journal of Chemical & Engineering Data; vol. 33; nb. 3; (1988); p. 247 - 250, View in Reaxys 33 of 40

Description (Liquid/ Activity coefficients of the components in the mixture Vapour Systems (MCS)) Temperature (Liquid/ 25 Vapour Systems (MCS)) [°C] Partner (Liquid/Vapour Systems (MCS))

benzene

Matteoli, Enrico; Lepori, Luciano; Journal of Chemical & Engineering Data; vol. 33; nb. 3; (1988); p. 247 - 250, View in Reaxys 34 of 40

Description (Liquid/ Liquid/vapour equilibrium Vapour Systems (MCS))

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Temperature (Liquid/ 25 Vapour Systems (MCS)) [°C] Partner (Liquid/Vapour Systems (MCS))

tetrachloromethane

Matteoli, Enrico; Lepori, Luciano; Journal of Chemical & Engineering Data; vol. 33; nb. 3; (1988); p. 247 - 250, View in Reaxys 35 of 40

Description (Liquid/ Activity coefficients of the components in the mixture Vapour Systems (MCS)) Temperature (Liquid/ 25 Vapour Systems (MCS)) [°C] Partner (Liquid/Vapour Systems (MCS))

tetrachloromethane

Matteoli, Enrico; Lepori, Luciano; Journal of Chemical & Engineering Data; vol. 33; nb. 3; (1988); p. 247 - 250, View in Reaxys 36 of 40

Description (Liquid/ Activity coefficients of the components in the mixture Vapour Systems (MCS)) Zakharov et al.; Russian Journal of Physical Chemistry; vol. 52; (1978); p. 847; ; p. 1479, View in Reaxys

37 of 40

Description (Liquid/ Liquid/vapour equilibrium Vapour Systems (MCS)) Gerster et al.; Journal of Chemical and Engineering Data; vol. 5; (1960); p. 423,425, View in Reaxys

38 of 40

Description (Liquid/ Liquid/vapour equilibrium Vapour Systems (MCS)) Pressure (Liquid/Vapour 760 Systems (MCS)) [Torr] Partner (Liquid/Vapour Systems (MCS))

water

Albanesi et al.; Chimica e l'Industria (Milan, Italy); vol. 39; (1957); p. 814, View in Reaxys 39 of 40

Description (Liquid/ Liquid/vapour equilibrium Vapour Systems (MCS)) Partner (Liquid/Vapour Systems (MCS))

i-Amyl alcohol

Patent; Stanolind Oil and Gas Co.; US2662847; (1952), View in Reaxys 40 of 40

Description (Liquid/ Vapour pressure diagram for the mixture Vapour Systems (MCS)) Comment (Liquid/ binaere Gemische.

Vapour Systems (MCS)) Partner (Liquid/Vapour Systems (MCS))

hexane; cyclohexane; benzene

Vandoni; Mem. Pudres; vol. 28; (1938); p. 236,242 ff, View in Reaxys Mechanical & Physical Properties (MCS) (19) 1 of 19

Description (Mechanical & Physical Properties (MCS))

Volume change on mixing

Temperature (Mechanical & Physical Properties (MCS)) [°C]

25

Partner (Mechanical & Physical Properties (MCS))

3-butyl-1-methyl-1H-imidazol-3-ium hexafluorophosphate

Wang, Jianji; Zhu, Anlian; Zhao, Yang; Zhuo, Kelei; Journal of Solution Chemistry; vol. 34; nb. 5; (2005); p. 585 596, View in Reaxys

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2 of 19

Description (Mechanical & Physical Properties (MCS))

Excess partial molal volume

Temperature (Mechanical & Physical Properties (MCS)) [°C]

25

Partner (Mechanical & Physical Properties (MCS))

dibutyl ether

Bernazzani, Luca; Ceccanti, Norberto; Conti, Giovanni; Gianni, Paolo; Mollica, Vincenzo; Rosaria Tine, Maria; Lepori, Luciano; Matteoli, Enrico; Spanedda, Andrea; Journal of Chemical Thermodynamics; vol. 33; nb. 6; (2001); p. 629 - 641, View in Reaxys 3 of 19

Description (Mechanical & Physical Properties (MCS))

Partial molal volume

Temperature (Mechanical & Physical Properties (MCS)) [°C]

25

Comment (Mechanical & Physical Properties (MCS))

concentration dependence

Partner (Mechanical & Physical Properties (MCS))

H2O

Hovorka, Stipan; Roux, Alain H.; Roux-Desgranges, Genevieve; Donnal, Vladimir; Journal of Solution Chemistry; vol. 28; nb. 12; (1999); p. 1289 - 1305, View in Reaxys 4 of 19

Description (Mechanical & Physical Properties (MCS))

Excess partial molal volume

Temperature (Mechanical & Physical Properties (MCS)) [°C]

25

Comment (Mechanical & Physical Properties (MCS))

concentration dependence

Partner (Mechanical & Physical Properties (MCS))

H2O

Hovorka, Stipan; Roux, Alain H.; Roux-Desgranges, Genevieve; Donnal, Vladimir; Journal of Solution Chemistry; vol. 28; nb. 12; (1999); p. 1289 - 1305, View in Reaxys 5 of 19

Description (Mechanical & Physical Properties (MCS))

Apparent molal volume

Temperature (Mechanical & Physical Properties (MCS)) [°C]

25

Comment (Mechanical & Physical Properties (MCS))

concentration dependence

Partner (Mechanical & Physical Properties (MCS))

H2O

Hovorka, Stipan; Roux, Alain H.; Roux-Desgranges, Genevieve; Donnal, Vladimir; Journal of Solution Chemistry; vol. 28; nb. 12; (1999); p. 1289 - 1305, View in Reaxys 6 of 19

Description (Mechanical & Physical Properties (MCS))

Volume change on mixing

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Temperature (Mechanical & Physical Properties (MCS)) [°C]

15 - 35

Partner (Mechanical & Physical Properties (MCS))

cyclohexane

Dernini, Stella; Polcaro, Anna Maria; Ricci, Pier Francesco; Marongiu, Bruno; Journal of Chemical & Engineering Data; vol. 34; nb. 2; (1989); p. 165 - 167, View in Reaxys 7 of 19

Description (Mechanical & Physical Properties (MCS))

Volume change on mixing

Temperature (Mechanical & Physical Properties (MCS)) [°C]

15 - 35

Partner (Mechanical & Physical Properties (MCS))

benzene

Dernini, Stella; Polcaro, Anna Maria; Ricci, Pier Francesco; Marongiu, Bruno; Journal of Chemical & Engineering Data; vol. 34; nb. 2; (1989); p. 165 - 167, View in Reaxys 8 of 19

Description (Mechanical & Physical Properties (MCS))

Volume change on mixing

Temperature (Mechanical & Physical Properties (MCS)) [°C]

15 - 35

Partner (Mechanical & Physical Properties (MCS))

tetrachloromethane

Dernini, Stella; Polcaro, Anna Maria; Ricci, Pier Francesco; Marongiu, Bruno; Journal of Chemical & Engineering Data; vol. 34; nb. 2; (1989); p. 165 - 167, View in Reaxys 9 of 19

Description (Mechanical & Physical Properties (MCS))

Volume change on mixing

Temperature (Mechanical & Physical Properties (MCS)) [°C]

25

Partner (Mechanical & Physical Properties (MCS))

hexane

Dernini; Polcaro; Ricci; Maronglu; Journal of Chemical and Engineering Data; vol. 32; nb. 2; (1987); p. 194 - 195, View in Reaxys 10 of 19

Description (Mechanical & Physical Properties (MCS))

Volume change on mixing

Temperature (Mechanical & Physical Properties (MCS)) [°C]

25

Partner (Mechanical & Physical Properties (MCS))

n-heptane

Dernini; Polcaro; Ricci; Maronglu; Journal of Chemical and Engineering Data; vol. 32; nb. 2; (1987); p. 194 - 195, View in Reaxys 11 of 19

Description (Mechanical & Physical Properties (MCS))

Volume change on mixing

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Temperature (Mechanical & Physical Properties (MCS)) [°C]

25

Partner (Mechanical & Physical Properties (MCS))

dodecane

Dernini; Polcaro; Ricci; Maronglu; Journal of Chemical and Engineering Data; vol. 32; nb. 2; (1987); p. 194 - 195, View in Reaxys 12 of 19

Description (Mechanical & Physical Properties (MCS))

Volume change on mixing

Temperature (Mechanical & Physical Properties (MCS)) [°C]

25

Partner (Mechanical & Physical Properties (MCS))

Hexadecane

Dernini; Polcaro; Ricci; Maronglu; Journal of Chemical and Engineering Data; vol. 32; nb. 2; (1987); p. 194 - 195, View in Reaxys 13 of 19

Description (Mechanical & Physical Properties (MCS))

Volume change on mixing

Temperature (Mechanical & Physical Properties (MCS)) [°C]

30

Partner (Mechanical & Physical Properties (MCS))

1,1,2,2-tetrachloroethylene

Iloukhani, Hossein; Reddy, K. Dayananda; Rao, M. V. Prabhakara; Journal of Chemical & Engineering Data; vol.

30; nb. 3; (1985); p. 306 - 308, View in Reaxys 14 of 19

Description (Mechanical & Physical Properties (MCS))

Volume change on mixing

Temperature (Mechanical & Physical Properties (MCS)) [°C]

40

Partner (Mechanical & Physical Properties (MCS))

1,1,2,2-tetrachloroethylene

Iloukhani, Hossein; Reddy, K. Dayananda; Rao, M. V. Prabhakara; Journal of Chemical & Engineering Data; vol.

30; nb. 3; (1985); p. 306 - 308, View in Reaxys 15 of 19

Description (Mechanical & Physical Properties (MCS))

Volume change on mixing

Temperature (Mechanical & Physical Properties (MCS)) [°C]

30

Partner (Mechanical & Physical Properties (MCS))

acetonitrile

Dharmaraju, G.; Narayanaswamy, G.; Raman, G. K.; Journal of Chemical & Engineering Data; vol. 27; nb. 2; (1982); p. 193 - 195, View in Reaxys 16 of 19

Description (Mechanical & Physical Properties (MCS))

Volume change on mixing

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Temperature (Mechanical & Physical Properties (MCS)) [°C]

30

Partner (Mechanical & Physical Properties (MCS))

N-butylamine

Sreenivasulu, M.; Naidu, P. R.; Indian Journal of Chemistry, Section A: Inorganic, Physical, Theoretical & Analytical; vol. 19; nb. 5; (1980); p. 470 - 471, View in Reaxys 17 of 19

Description (Mechanical & Physical Properties (MCS))

Volume change on mixing

Rao; Naidu; Journal of Chemical Thermodynamics; vol. 8; (1976); p. 73,74, 75, View in Reaxys; Sreenivasulu; Naidu; Australian Journal of Chemistry; vol. 32; (1979); p. 1649,1650,1651, View in Reaxys 18 of 19

Description (Mechanical & Physical Properties (MCS))

Partial molal volume

Edward,J.T. et al.; Canadian Journal of Chemistry; vol. 57; (1979); p. 2892 - 2894, View in Reaxys 19 of 19

Description (Mechanical & Physical Properties (MCS))

Volume change on mixing

Temperature (Mechanical & Physical Properties (MCS)) [°C]

28

Partner (Mechanical & Physical Properties (MCS))

Glutaronitrile

Phibbs; Journal of Physical Chemistry; vol. 59; (1955); p. 346,249, View in Reaxys Mechanical Properties (3) Description (MeReferences chanical Properties) Specific volume

Golovnya, R. V.; Grigor'eva, D. N.; Bulletin of the Academy of Sciences of the USSR, Division of Chemical Science (English Translation); vol. 32; (1983); p. 1124 - 1127; Izvestiya Akademii Nauk SSSR, Seriya Khimicheskaya; nb. 6; (1983); p. 1246 - 1249, View in Reaxys

Molar volume

Edward et al.; Journal of the Chemical Society, Faraday Transactions 1: Physical Chemistry in Condensed Phases; vol. 73; (1977); p. 705,707, View in Reaxys; Sreenivasulu, M.; Naidu, P. R.; Indian Journal of Chemistry, Section A: Inorganic, Physical, Theoretical & Analytical; vol. 19; nb. 5; (1980); p. 470 - 471, View in Reaxys

PVT Relationship

Brazier; Freemann; Canadian Journal of Chemistry; vol. 47; (1969); p. 885, View in Reaxys

Molecular Deformation (4) Description (MoComment (Molec- References lecular Deforma- ular Deformation) tion) Fundamental vibrations

Carreira; Lord; Journal of Chemical Physics; vol. 51; (1969); p. 3225,3226, View in Reaxys; Durig et al.; Journal of Molecular Spectroscopy; vol. 27; (1968); p. 285, View in Reaxys; Sablayrolles et al.; Journal de Chimie Physique et de Physico-Chimie Biologique; vol. 66; (1969); p. 1139, View in Reaxys; Chiang, Whe-Yi; Laane, Jaan; Journal of Physical Chemistry; vol. 99; nb. 30; (1995); p. 11640 - 11643, View in Reaxys

Force constants

Alameddine, Omar K.; Journal of Molecular Structure; vol. 356; nb. 1; (1995); p. 1 - 6, View in Reaxys

Fundamental vibrations

im 1. angeregten Zustand.

Prugger; Doerr; Zeitschrift fuer Elektrochemie und Angewandte Physikalische Chemie; vol. 64; (1960); p. 425; Chem.Abstr.; vol. 54; nb. 13855; (1960), View in Reaxys

Fundamental vibrations

des Molekuels im Grundzustand.

Mecke et al.; Chemische Berichte; vol. 90; (1957); p. 975,977, View in Reaxys

Optics (5) Description (Optics)

Comment (Optics)

References

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Linear dichroism

Causley, G. C.; Russell, B. R.; Journal of Chemical Physics; vol. 72; nb. 4; (1980); p.

2623 - 2631, View in Reaxys

Magnetic circular dichroism

Totty; Hudec; Journal of the Chemical Society [Section] D: Chemical Communications; (1971); p. 1533, View in Reaxys; Seamans et al.; Journal of the American Chemical Society; vol. 94; (1972); p. 6464,6472,6473, View in Reaxys

Electric birefringence (Kerr effect)

Le Fevre et al.; Journal of the Chemical Society [Section] B: Physical Organic; (1968); p.

148, View in Reaxys

Electric birefringence (Kerr effect)

Kerr-Konstante (CCl4).

Mechanical birefringence

Le Fevre; Le Fevre; Journal of the Chemical Society; (1956); p. 3549,3561, View in Reaxys Vorlaender; Specht; Zeitschrift fuer Physikalische Chemie (Leipzig); vol. <A> 178; (1936); p. 93,108, View in Reaxys; Vorlaender; Transactions of the Faraday Society; vol.

29; (1933); p. 910,912, View in Reaxys

Other Thermochemical Data (5) Description (Oth- Comment (Other er Thermochemi- Thermochemical cal Data) Data)

References

Entropy

Meyer; Gens; Journal of Chemical Thermodynamics; vol. 11; (1979); p. 719,721, 722, View in Reaxys; Mayer et al.; Journal of Chemical Thermodynamics; vol. 9; (1977); p.

439,441, View in Reaxys

Enthalpy

Meyer; Gens; Journal of Chemical Thermodynamics; vol. 11; (1979); p. 719,721, 722, View in Reaxys; Davis; Carter; Tetrahedron; vol. 22; (1966); p. 495,497, View in Reaxys

Thermodynamic properties

Meyer; Gens; Journal of Chemical Thermodynamics; vol. 11; (1979); p. 719,721, 722, View in Reaxys; Arnett et al.; Journal of the American Chemical Society; vol. 96; (1974); p. 3875,3877,3879,3883,3886, View in Reaxys; Mayer et al.; Journal of Chemical Thermodynamics; vol. 9; (1977); p. 439,441, View in Reaxys; Saluja et al.; Journal of the American Chemical Society; vol. 101; (1979); p. 1958,1959,1960, View in Reaxys; Price; Iwasa; Bulletin of the Chemical Society of Japan; vol. 49; (1976); p. 214,215, 216, View in Reaxys

Cryoscopic constant

Kryoskopie in Methansulfonsaeure.

Craig et al.; Journal of the American Chemical Society; vol. 72; (1950); p. 163,164, View in Reaxys

Heat of combustion at constant volume

682.0 kcal/Mol.

Roth; v. Auwers; in Landolt-Boernst. H, 1599, View in Reaxys

Solubility (MCS) (5) 1 of 5

Saturation

in pure solvent

Kamlet, Mortimer J.; Doherty, Ruth M.; Abraham, Michael H.; Carr, Peter W.; Doherty, Robert F.; Taft, Robert W.; Journal of Physical Chemistry; vol. 91; nb. 7; (1987); p. 1996 - 2004, View in Reaxys; Kamlet; Doherty; Abboud; Abraham; Taft; Journal of Pharmaceutical Sciences; vol. 75; nb. 4; (1986); p. 338 - 349, View in Reaxys 2 of 5

Guthrie; Cullimore; Canadian Journal of Chemistry; vol. 57; (1979); p. 240,241, View in Reaxys

3 of 5

Temperature (Solubility (MCS)) [°C]

25

Solvent (Solubility (MCS))

H2O

Comment (Solubility (MCS))

100 g solvent dissolves. 29.7 g Substance.

Patent; Stanolind Oil and Gas Co.; US2662847; (1952), View in Reaxys 4 of 5

Temperature (Solubility (MCS)) [°C]

90

Solvent (Solubility (MCS))

H2O

Comment (Solubility (MCS))

100 g solvent dissolves. 27.0 g Substance.

Patent; Stanolind Oil and Gas Co.; US2662847; (1952), View in Reaxys

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5 of 5

Temperature (Solubility (MCS)) [°C]

25

Solvent (Solubility (MCS))

H2O

Patent; Phillips Petr. Co.; US2623072; (1946), View in Reaxys Solution Behaviour (MCS) (4) 1 of 4

Description (Solution Behaviour (MCS))

Mutual solubility

Temperature (Solution Behaviour (MCS)) [°C]

0 - 90.7

Partner (Solution Behaviour (MCS))

H2O

Stephenson; Journal of Chemical and Engineering Data; vol. 37; nb. 1; (1992); p. 80 - 95, View in Reaxys 2 of 4

Description (Solution Behaviour (MCS))

Dissolving capacity

Markowitz et al.; Journal of Chemical and Engineering Data; vol. 6; (1961); p. 325, View in Reaxys 3 of 4

Description (Solution Behaviour (MCS))

Dissolving capacity

Temperature (Solution Behaviour (MCS)) [°C]

25

Partner (Solution Behaviour (MCS))

NaI

Harris; U.S. Atomic Energy Comm.; UCRL-8381 <1958> 6, 34, View in Reaxys 4 of 4

Description (Solution Behaviour (MCS))

Dissolving capacity

Temperature (Solution Behaviour (MCS)) [°C]

25

Partner (Solution Behaviour (MCS))

KI

Harris; U.S. Atomic Energy Comm.; UCRL-8381 <1958> 6, 34, View in Reaxys Sound Properties (1) Description References (Sound Properties) Velocity of sound

Padmini et al.; Transactions of the Faraday Society; vol. 56; (1960); p. 1404,1405, View in Reaxys; Rao; Naidu; Journal of Chemical Thermodynamics; vol. 8; (1976); p. 73,74, 75, View in Reaxys; Sreenivasulu; Naidu; Australian Journal of Chemistry; vol. 32; (1979); p. 1649,1650,1651, View in Reaxys

Static Dielectric Constant (5) Static Dielectric Temperature Constant (Static Dielectric Constant) [°C]

References

14.21 - 13.78

15 - 30

Gaeumann et al.; Helvetica Chimica Acta; vol. 39; (1956); p. 145,151, View in Reaxys

2.84 - 3.38

-100 - -55

Gaeumann et al.; Helvetica Chimica Acta; vol. 39; (1956); p. 145,151, View in Reaxys

16.59 - 13.58

-54 - 25

Gaeumann et al.; Helvetica Chimica Acta; vol. 39; (1956); p. 145,151, View in Reaxys

2.813 - 2.867

-74.7 - -51.8

Philippe; Piette; Bulletin des Societes Chimiques Belges; vol. 64; (1955); p. 600,623, View in Reaxys

15.99 - 13.48

-51.9 - 20

Philippe; Piette; Bulletin des Societes Chimiques Belges; vol. 64; (1955); p. 600,623, View in Reaxys

Surface Tension (11) Surface Tension Temperature [g·s-2] (Surface Tension) [°C]

References

Copyright © 2017 Reed Elsevier Properties SA. All rights reserved. Authorized use only. Reaxys® and the Reaxys® trademark are owned and protected by Reed Elsevier Properties SA and used under license.

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33

25

Habrdova, Katerina; Hovorka, Stepan; Bartovska, Lidmila; Journal of Chemical and Engineering Data; vol. 49; nb. 4; (2004); p. 1003 - 1007, View in Reaxys

33.31

20

Vogel; Journal of the Chemical Society; (1938); p. 1323,1328, View in Reaxys

32.98

23

Vogel; Journal of the Chemical Society; (1938); p. 1323,1328, View in Reaxys

28.57

64.1

Vogel; Journal of the Chemical Society; (1938); p. 1323,1328, View in Reaxys

26.01

86.5

Vogel; Journal of the Chemical Society; (1938); p. 1323,1328, View in Reaxys

33.87 - 34.37

15 - 20

Timmermans; Hennaut-Roland; Journal de Chimie Physique et de Physico-Chimie Biologique; vol. 34; (1937); p. 711; Chem. Zentralbl.; vol. 109; nb. II; (1938); p. 517, View in Reaxys

32.58

30

Timmermans; Hennaut-Roland; Journal de Chimie Physique et de Physico-Chimie Biologique; vol. 34; (1937); p. 711; Chem. Zentralbl.; vol. 109; nb. II; (1938); p. 517, View in Reaxys

32.33

29

Ray; Journal of the Indian Chemical Society; vol. 11; (1934); p. 499, View in Reaxys

26.4

85.4

Vogel; Journal of the Chemical Society; (1928); p. 2025, View in Reaxys

29.04

61.6

Vogel; Journal of the Chemical Society; (1928); p. 2025, View in Reaxys

34.08

18

Vogel; Journal of the Chemical Society; (1928); p. 2025, View in Reaxys

Transport Phenomena (MCS) (14) 1 of 14

Description (Transport Phenomena (MCS))

Diffusion coefficient

Temperature (Transport 60 Phenomena (MCS)) [°C] Partner (Transport Phenomena (MCS))

high-epoxide functionality SU8-2100 resin

Antonio, Christian; Deam, Rowan T.; Physical Chemistry Chemical Physics; vol. 9; nb. 23; (2007); p. 2976 - 2982, View in Reaxys 2 of 14

Description (Transport Phenomena (MCS))

Diffusion coefficient

Temperature (Transport 70 Phenomena (MCS)) [°C] Partner (Transport Phenomena (MCS))

high-epoxide functionality SU8-2100 resin

Antonio, Christian; Deam, Rowan T.; Physical Chemistry Chemical Physics; vol. 9; nb. 23; (2007); p. 2976 - 2982, View in Reaxys 3 of 14

Description (Transport Phenomena (MCS))

Diffusion coefficient

Temperature (Transport 75 Phenomena (MCS)) [°C] Partner (Transport Phenomena (MCS))

high-epoxide functionality SU8-2100 resin

Antonio, Christian; Deam, Rowan T.; Physical Chemistry Chemical Physics; vol. 9; nb. 23; (2007); p. 2976 - 2982, View in Reaxys 4 of 14

Description (Transport Phenomena (MCS))

Diffusion coefficient

Temperature (Transport 95 Phenomena (MCS)) [°C] Partner (Transport Phenomena (MCS))

high-epoxide functionality SU8-2100 resin

Antonio, Christian; Deam, Rowan T.; Physical Chemistry Chemical Physics; vol. 9; nb. 23; (2007); p. 2976 - 2982, View in Reaxys 5 of 14

Description (Transport Phenomena (MCS))

Diffusion coefficient

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Comment (Transport Phenomena (MCS))

temperature dependence. Object(s) of Study: equation. Object(s) of Study: diagram

Partner (Transport Phenomena (MCS))

high-epoxide functionality SU8-2100 resin

Antonio, Christian; Deam, Rowan T.; Physical Chemistry Chemical Physics; vol. 9; nb. 23; (2007); p. 2976 - 2982, View in Reaxys 6 of 14

Description (Transport Phenomena (MCS))

Diffusion coefficient

Temperature (Transport 60 Phenomena (MCS)) [°C] Comment (Transport Phenomena (MCS))

influence of an electric field

Partner (Transport Phenomena (MCS))

high-epoxide functionality SU8-2100 resin

Antonio, Christian; Deam, Rowan T.; Physical Chemistry Chemical Physics; vol. 9; nb. 23; (2007); p. 2976 - 2982, View in Reaxys 7 of 14

Description (Transport Phenomena (MCS))

Diffusion coefficient

Temperature (Transport 70 Phenomena (MCS)) [°C] Comment (Transport Phenomena (MCS))

influence of an electric field

Partner (Transport Phenomena (MCS))

high-epoxide functionality SU8-2100 resin

Antonio, Christian; Deam, Rowan T.; Physical Chemistry Chemical Physics; vol. 9; nb. 23; (2007); p. 2976 - 2982, View in Reaxys 8 of 14

Description (Transport Phenomena (MCS))

Diffusion coefficient

Temperature (Transport 75 Phenomena (MCS)) [°C] Comment (Transport Phenomena (MCS))

influence of an electric field

Partner (Transport Phenomena (MCS))

high-epoxide functionality SU8-2100 resin

Antonio, Christian; Deam, Rowan T.; Physical Chemistry Chemical Physics; vol. 9; nb. 23; (2007); p. 2976 - 2982, View in Reaxys 9 of 14

Description (Transport Phenomena (MCS))

Diffusion coefficient

Temperature (Transport 95 Phenomena (MCS)) [°C] Comment (Transport Phenomena (MCS))

influence of an electric field

Partner (Transport Phenomena (MCS))

high-epoxide functionality SU8-2100 resin

Antonio, Christian; Deam, Rowan T.; Physical Chemistry Chemical Physics; vol. 9; nb. 23; (2007); p. 2976 - 2982, View in Reaxys 10 of 14

Description (Transport Phenomena (MCS))

Diffusion coefficient

Comment (Transport Phenomena (MCS))

influence of an electric field. Object(s) of Study: temperature dependence. Object(s) of Study: equation

Partner (Transport Phenomena (MCS))

high-epoxide functionality SU8-2100 resin

Copyright © 2017 Reed Elsevier Properties SA. All rights reserved. Authorized use only. Reaxys® and the Reaxys® trademark are owned and protected by Reed Elsevier Properties SA and used under license.

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Antonio, Christian; Deam, Rowan T.; Physical Chemistry Chemical Physics; vol. 9; nb. 23; (2007); p. 2976 - 2982, View in Reaxys 11 of 14

Description (Transport Phenomena (MCS))

Viscosity

Temperature (Transport 25 Phenomena (MCS)) [°C] Partner (Transport Phenomena (MCS))

3-butyl-1-methyl-1H-imidazol-3-ium hexafluorophosphate

Wang, Jianji; Zhu, Anlian; Zhao, Yang; Zhuo, Kelei; Journal of Solution Chemistry; vol. 34; nb. 5; (2005); p. 585 596, View in Reaxys 12 of 14

Description (Transport Phenomena (MCS))

Diffusion

Temperature (Transport 40.9 Phenomena (MCS)) [°C] Pressure (Transport Phenomena (MCS)) [Torr]

75005.9 - 135011

Partner (Transport Phenomena (MCS))

carbon dioxide

Dahmen, Nicolaus; Duelberg, Andreas; Schneider, Gerhard M.; Berichte der Bunsen-Gesellschaft; vol. 94; nb. 3; (1990); p. 384 - 386, View in Reaxys 13 of 14

Description (Transport Phenomena (MCS))

Viscosity

Temperature (Transport 30 Phenomena (MCS)) [°C] Partner (Transport Phenomena (MCS))

N-butylamine

Sreenivasulu, M.; Naidu, P. R.; Indian Journal of Chemistry, Section A: Inorganic, Physical, Theoretical & Analytical; vol. 19; nb. 5; (1980); p. 470 - 471, View in Reaxys 14 of 14

Description (Transport Phenomena (MCS))

Viscosity

Rao; Naidu; Indian Journal of Chemistry, Section A: Inorganic, Physical, Theoretical and Analytical; vol. 15; (1977); p. 239, View in Reaxys Vapour Pressure (5) Vapour Pressure Temperature (Va[Torr] pour Pressure) [°C] 31.277 - 1417.71

44.5 - 154.5

Comment (Vapour Pressure)

References

Table exists.

Ambrose, D.; Ghiassee, N. B.; Journal of Chemical ThermodynamEquation: 2 equa- ics; vol. 19; nb. 9; (1987); p. 903 - 910, View in Reaxys tions Meyer; Holz; Journal of Chemical and Engineering Data; vol. 21; (1976); p. 274,275-278, View in Reaxys; Guthrie; Cullimore; Canadian Journal of Chemistry; vol. 57; (1979); p. 240,241, View in Reaxys

2794.93 12135.9

182 - 265.5

Kobe et al.; Industrial and Engineering Chemistry; vol. 47; (1955); p.

1767,1771, View in Reaxys

7.64 - 8.92

18.4 - 21.1

Baughan et al.; Proceedings of the Royal Society of London, Series A: Mathematical, Physical and Engineering Sciences; vol. 225; (1954); p. 478,502, View in Reaxys

28.9

40

Vandoni; Memorial des Poudres; vol. 28; (1938); p. 236,242, View in Reaxys

NMR Spectroscopy (46) 1 of 46

Description (NMR Spec- Chemical shifts troscopy)

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Nucleus (NMR Spectroscopy)

1H

Solvents (NMR Spectro- chloroform-d1 scopy) Temperature (NMR Spectroscopy) [°C]

29.84

Glaszczka, Rafal; Jazwinski, Jaroslaw; Journal of Molecular Structure; vol. 1036; (2013); p. 78 - 89, View in Reaxys 2 of 46

Description (NMR Spec- Chemical shifts troscopy) Nucleus (NMR Spectroscopy)

13C

Solvents (NMR Spectro- chloroform-d1 scopy) Temperature (NMR Spectroscopy) [°C]

29.84

Glaszczka, Rafal; Jazwinski, Jaroslaw; Journal of Molecular Structure; vol. 1036; (2013); p. 78 - 89, View in Reaxys 3 of 46

Description (NMR Spec- Chemical shifts; Spectrum troscopy) Nucleus (NMR Spectroscopy)

1H

Solvents (NMR Spectro- chloroform-d1 scopy) Frequency (NMR Spectroscopy) [MHz]

500

Location

supporting information

Zhang, Guofu; Wen, Xin; Wang, Yong; Mo, Weimin; Ding, Chengrong; Journal of Organic Chemistry; vol. 76; nb.

11; (2011); p. 4665 - 4668, View in Reaxys 4 of 46

Description (NMR Spec- Chemical shifts; Spectrum troscopy) Nucleus (NMR Spectroscopy)

13C

Solvents (NMR Spectro- chloroform-d1 scopy) Frequency (NMR Spectroscopy) [MHz]

125

Location

supporting information

Zhang, Guofu; Wen, Xin; Wang, Yong; Mo, Weimin; Ding, Chengrong; Journal of Organic Chemistry; vol. 76; nb.

11; (2011); p. 4665 - 4668, View in Reaxys 5 of 46

Description (NMR Spec- Chemical shifts troscopy) Nucleus (NMR Spectroscopy)

1H

Solvents (NMR Spectro- chloroform-d1 scopy) Frequency (NMR Spectroscopy) [MHz]

400

Wu, Shang; Ma, Hengchang; Lei, Ziqiang; Tetrahedron; vol. 66; nb. 45; (2010); p. 8641 - 8647, View in Reaxys; Moskalenko; Belopukhov; Ivlev; Boev; Russian Journal of Organic Chemistry; vol. 47; nb. 7; (2011); p. 1091 1096, View in Reaxys 6 of 46

Description (NMR Spec- Chemical shifts troscopy)

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Nucleus (NMR Spectroscopy)

13C

Solvents (NMR Spectro- chloroform-d1 scopy) Frequency (NMR Spectroscopy) [MHz]

100

Wu, Shang; Ma, Hengchang; Lei, Ziqiang; Tetrahedron; vol. 66; nb. 45; (2010); p. 8641 - 8647, View in Reaxys 7 of 46

Description (NMR Spec- Chemical shifts; Spectrum troscopy) Nucleus (NMR Spectroscopy)

1H

Solvents (NMR Spectro- chloroform-d1 scopy) Temperature (NMR Spectroscopy) [°C]

20

Frequency (NMR Spectroscopy) [MHz]

300

Location

supporting information

Lakshmi Kantam; Arundhathi; Likhar, Pravin R.; Damodara; Advanced Synthesis and Catalysis; vol. 351; nb. 16; (2009); p. 2633 - 2637, View in Reaxys 8 of 46

Description (NMR Spec- Chemical shifts; Spectrum troscopy) Nucleus (NMR Spectroscopy)

13C

Solvents (NMR Spectro- chloroform-d1; dimethylsulfoxide-d6 scopy) Temperature (NMR Spectroscopy) [°C]

20

Frequency (NMR Spectroscopy) [MHz]

75

Location

supporting information

Lakshmi Kantam; Arundhathi; Likhar, Pravin R.; Damodara; Advanced Synthesis and Catalysis; vol. 351; nb. 16; (2009); p. 2633 - 2637, View in Reaxys 9 of 46

Description (NMR Spec- Chemical shifts troscopy) Nucleus (NMR Spectroscopy)

1H

Solvents (NMR Spectro- CDCl3 scopy) Frequency (NMR Spectroscopy) [MHz]

90

Khazaei, Ardeshir; Sadri, Minoo; Hosseini, Hassan; Journal of the Chinese Chemical Society; vol. 54; nb. 4; (2007); p. 1011 - 1015, View in Reaxys 10 of 46

Description (NMR Spec- Chemical shifts troscopy) Nucleus (NMR Spectroscopy)

1H

Solvents (NMR Spectro- CDCl3 scopy) Frequency (NMR Spectroscopy) [MHz]

400

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Sato, Kazuhiko; Aoki, Masao; Takagi, Junko; Zimmermann, Klaus; Noyori, Ryoji; Bulletin of the Chemical Society of Japan; vol. 72; nb. 10; (1999); p. 2287 - 2306, View in Reaxys 11 of 46

Description (NMR Spec- Chemical shifts troscopy) Nucleus (NMR Spectroscopy)

13C

Solvents (NMR Spectro- CDCl3 scopy) Frequency (NMR Spectroscopy) [MHz]

100

Sato, Kazuhiko; Aoki, Masao; Takagi, Junko; Zimmermann, Klaus; Noyori, Ryoji; Bulletin of the Chemical Society of Japan; vol. 72; nb. 10; (1999); p. 2287 - 2306, View in Reaxys 12 of 46

Description (NMR Spec- Chemical shifts troscopy) Nucleus (NMR Spectroscopy)

13C

Servis,K.L.; Shue,F.F.; Journal of the American Chemical Society; vol. 102; (1980); p. 7233, View in Reaxys; Lambert, Joseph B.; Wharry, Stephen M.; Block, Eric; Bazzi, Ali A.; Journal of Organic Chemistry; vol. 48; nb. 22; (1983); p. 3982 - 3985, View in Reaxys; Lambert, Joseph B.; Johnson, Suzanne C.; Xue, Liang; Journal of the American Chemical Society; vol. 116; nb. 14; (1994); p. 6167 - 6174, View in Reaxys; Syroezhko; Proskuryakov; Russian Journal of Applied Chemistry; vol. 71; nb. 8; (1998); p. 1421 - 1425, View in Reaxys 13 of 46

Description (NMR Spec- Chemical shifts troscopy) Nucleus (NMR Spectroscopy)

13C

Solvents (NMR Spectro- CDCl3 scopy) Temperature (NMR Spectroscopy) [°C]

20

Zhuo, Jin-Cong; Magnetic Resonance in Chemistry; vol. 35; nb. 10; (1997); p. 717 - 719, View in Reaxys 14 of 46

Description (NMR Spec- Chemical shifts troscopy) Nucleus (NMR Spectroscopy)

17O

Solvents (NMR Spectro- acetonitrile scopy) Temperature (NMR Spectroscopy) [°C]

40

Zhuo, Jin-Cong; Magnetic Resonance in Chemistry; vol. 34; nb. 8; (1996); p. 595 - 602, View in Reaxys 15 of 46

Description (NMR Spec- Linewidth of NMR absorption troscopy) Negrebetskii, Vad. V.; Russian Journal of General Chemistry; vol. 63; nb. 9.2; (1993); p. 1436 - 1440; Zhurnal Obshchei Khimii; vol. 63; nb. 9; (1993); p. 2059 - 2066, View in Reaxys; Zhuo, Jin-Cong; Magnetic Resonance in Chemistry; vol. 34; nb. 8; (1996); p. 595 - 602, View in Reaxys

16 of 46

Description (NMR Spec- Spectrum troscopy) Nucleus (NMR Spectroscopy)

13C

Temperature (NMR Spectroscopy) [°C]

-100 - -70

Lambert, Joseph B.; Johnson, Suzanne C.; Xue, Liang; Journal of the American Chemical Society; vol. 116; nb.

14; (1994); p. 6167 - 6174, View in Reaxys

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17 of 46

Description (NMR Spec- Chemical shifts troscopy) Nucleus (NMR Spectroscopy)

13C

Solvents (NMR Spectro- various solvent(s) scopy) Negrebetskii, Vad. V.; Russian Journal of General Chemistry; vol. 63; nb. 9.2; (1993); p. 1436 - 1440; Zhurnal Obshchei Khimii; vol. 63; nb. 9; (1993); p. 2059 - 2066, View in Reaxys 18 of 46

Description (NMR Spec- Chemical shifts troscopy) Nucleus (NMR Spectroscopy)

17O

Solvents (NMR Spectro- various solvent(s) scopy) Negrebetskii, Vad. V.; Russian Journal of General Chemistry; vol. 63; nb. 9.2; (1993); p. 1436 - 1440; Zhurnal Obshchei Khimii; vol. 63; nb. 9; (1993); p. 2059 - 2066, View in Reaxys 19 of 46

Description (NMR Spec- Chemical shifts troscopy) Nucleus (NMR Spectroscopy)

13C

Solvents (NMR Spectro- dimethylsulfoxide scopy) Temperature (NMR Spectroscopy) [°C]

90

Negrebetskii, Vad. V.; Russian Journal of General Chemistry; vol. 63; nb. 9.2; (1993); p. 1436 - 1440; Zhurnal Obshchei Khimii; vol. 63; nb. 9; (1993); p. 2059 - 2066, View in Reaxys 20 of 46

Description (NMR Spec- Chemical shifts troscopy) Nucleus (NMR Spectroscopy)

17O

Solvents (NMR Spectro- dimethylsulfoxide scopy) Temperature (NMR Spectroscopy) [°C]

90

Negrebetskii, Vad. V.; Russian Journal of General Chemistry; vol. 63; nb. 9.2; (1993); p. 1436 - 1440; Zhurnal Obshchei Khimii; vol. 63; nb. 9; (1993); p. 2059 - 2066, View in Reaxys 21 of 46

Description (NMR Spec- Chemical shifts troscopy) Nucleus (NMR Spectroscopy)

13C

Solvents (NMR Spectro- CDCl3 scopy) Schneider,H.J.; Nguyen-Ba,N.; Thomas,F.; Tetrahedron; vol. 38; (1982); p. 2327, View in Reaxys; Jones,R.A.; Stokes,M.J.; Tetrahedron; vol. 40; (1984); p. 1051, View in Reaxys; Griesbaum, Karl; Krieger-Beck, Petra; Beck, Johannes; Chemische Berichte; vol. 124; nb. 2; (1991); p. 391 - 396, View in Reaxys; Olah, Georgen A.; Nakajima, Tadashi; Prakash, G. K. Surya; Angewandte Chemie; vol. 92; nb. 10; (1980); p. 837 - 838, View in Reaxys; Cerichelli, Giorgio; Frachey, Giuseppe; Galli, Carlo; Gazzetta Chimica Italiana; vol. 116; nb. 12; (1986); p. 683 686, View in Reaxys 22 of 46

Description (NMR Spec- Chemical shifts troscopy) Nucleus (NMR Spectroscopy)

1H

Solvents (NMR Spectro- CDCl3 scopy)

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Jedlinski; Misioiek; Giowkowski; Janeczek; Wolinska; Tetrahedron; vol. 46; nb. 10; (1990); p. 3547 - 3558, View in Reaxys; Mitra, R. B.; Reddy, G. Bhaskar; Synthesis; nb. 9; (1989); p. 694 - 698, View in Reaxys; Cerichelli, Giorgio; Frachey, Giuseppe; Galli, Carlo; Gazzetta Chimica Italiana; vol. 116; nb. 12; (1986); p. 683 - 686, View in Reaxys; Ogawa; Fujinami; Taya; Teratani; Bulletin of the Chemical Society of Japan; vol. 57; nb. 7; (1984); p. 1908 - 1913, View in Reaxys 23 of 46

Description (NMR Spec- Chemical shifts troscopy) Nucleus (NMR Spectroscopy)

13C

Solvents (NMR Spectro- neat (no solvent) scopy) Danilov, V. A.; Barysheva, N. A.; Postylyakov, A. B.; Rybina, E. A.; Sapozhnikov, Yu. E.; J. Appl. Chem. USSR (Engl. Transl.); vol. 62; nb. 1.2; (1989); p. 144 - 147,130 - 133, View in Reaxys 24 of 46

Description (NMR Spec- Chemical shifts troscopy) Nucleus (NMR Spectroscopy)

1H

Solvents (NMR Spectro- H2SO4; H2O scopy) Freiberg, W.; Roth, H.; Rautenberg, Ute; Kroeger, C.-F.; Journal fuer Praktische Chemie (Leipzig); vol. 331; nb. 3; (1989); p. 431 - 438, View in Reaxys 25 of 46

Description (NMR Spec- Spectrum troscopy) Nucleus (NMR Spectroscopy)

1H

Solvents (NMR Spectro- benzene-d6 scopy) Esteban, A. L.; Galache, M. P.; Diez, E.; Altona, C.; Smits, G. F.; Journal of Molecular Structure; vol. 142; (1986); p. 379 - 382, View in Reaxys 26 of 46

Description (NMR Spec- Spin-spin coupling constants troscopy) Solvents (NMR Spectro- benzene-d6 scopy) Comment (NMR Spectroscopy)

1H-1H

Esteban, A. L.; Galache, M. P.; Diez, E.; Altona, C.; Smits, G. F.; Journal of Molecular Structure; vol. 142; (1986); p. 379 - 382, View in Reaxys 27 of 46

Description (NMR Spec- Spin-spin coupling constants troscopy) Solvents (NMR Spectro- CDCl3 scopy) Comment (NMR Spectroscopy)

1H-13C.

Cerichelli, Giorgio; Frachey, Giuseppe; Galli, Carlo; Gazzetta Chimica Italiana; vol. 116; nb. 12; (1986); p. 683 686, View in Reaxys 28 of 46

Description (NMR Spec- Spin-spin coupling constants troscopy) Comment (NMR Spectroscopy)

1H-13C. Solvent(s): further solvent(s)

Cerichelli, Giorgio; Frachey, Giuseppe; Galli, Carlo; Gazzetta Chimica Italiana; vol. 116; nb. 12; (1986); p. 683 686, View in Reaxys 29 of 46

Description (NMR Spec- Spin-spin coupling constants troscopy)

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Solvents (NMR Spectro- benzene-d6 scopy) Comment (NMR Spectroscopy)

13C-13C.

Cho, Jung-Hyuck; Klessinger, Martin; Tecklenborg, Ute; Wilhelm, Konrad; Magnetic Resonance in Chemistry; vol. 23; nb. 2; (1985); p. 95 - 100, View in Reaxys 30 of 46

Description (NMR Spec- Spin-spin coupling constants troscopy) Comment (NMR Spectroscopy)

13C-13C

Krivdin, Leonid B.; Kalabin, Gennady A.; Nesterenko, Raisa N.; Trofimov, Boris A.; Tetrahedron Letters; vol.

25; nb. 42; (1984); p. 4817 - 4820, View in Reaxys 31 of 46

Description (NMR Spec- Chemical shifts troscopy) Nucleus (NMR Spectroscopy)

17O

Lambert, Joseph B.; Wharry, Stephen M.; Block, Eric; Bazzi, Ali A.; Journal of Organic Chemistry; vol. 48; nb.

22; (1983); p. 3982 - 3985, View in Reaxys 32 of 46

Description (NMR Spec- Chemical shifts troscopy) Nucleus (NMR Spectroscopy)

13C

Solvents (NMR Spectro- dimethylsulfoxide-d6 scopy) Temperature (NMR Spectroscopy) [°C]

25

Machacek, Vladimir; Sterba,Vojeslav; Lycka, Antonin; Snobl, Dobroslav; Journal of the Chemical Society, Perkin Transactions 2: Physical Organic Chemistry (1972-1999); (1982); p. 355 - 360, View in Reaxys 33 of 46

Description (NMR Spec- Chemical shifts troscopy) Nucleus (NMR Spectroscopy)

17O

Solvents (NMR Spectro- benzene-d6 scopy) Temperature (NMR Spectroscopy) [°C]

32

Delseth, Claude; Kintzinger, Jean-Pierre; Helvetica Chimica Acta; vol. 65; nb. 7; (1982); p. 2273 - 2279, View in Reaxys 34 of 46

Description (NMR Spec- Chemical shifts troscopy) Nucleus (NMR Spectroscopy)

13C

Solvents (NMR Spectro- benzene-d6 scopy) Temperature (NMR Spectroscopy) [°C]

32

Delseth, Claude; Kintzinger, Jean-Pierre; Helvetica Chimica Acta; vol. 65; nb. 7; (1982); p. 2273 - 2279, View in Reaxys 35 of 46

Description (NMR Spec- NOE troscopy) Delseth, Claude; Kintzinger, Jean-Pierre; Helvetica Chimica Acta; vol. 65; nb. 7; (1982); p. 2273 - 2279, View in Reaxys

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36 of 46

Description (NMR Spec- Chemical shifts troscopy) Nucleus (NMR Spectroscopy)

13C

Solvents (NMR Spectro- fluorosulfonic acid; not given scopy) Temperature (NMR Spectroscopy) [°C]

-70

Olah, Georgen A.; Nakajima, Tadashi; Prakash, G. K. Surya; Angewandte Chemie; vol. 92; nb. 10; (1980); p. 837 - 838, View in Reaxys 37 of 46

Description (NMR Spec- Spin-lattice relaxation time (T1) troscopy) Komoroski; Levy; Journal of Physical Chemistry; vol. 80; (1976); p. 2410, View in Reaxys; Sterk et al.; Zeitschrift fuer Physikalische Chemie (Muenchen, Germany); vol. 118; (1979); p. 151,155, View in Reaxys

38 of 46

Description (NMR Spec- NMR troscopy) Gray,G.A. et al.; Journal of the American Chemical Society; vol. 98; (1976); p. 2109 - 2118, View in Reaxys; Stothers,J.B.; Tan,C.T.; Canadian Journal of Chemistry; vol. 52; (1974); p. 308, View in Reaxys; Gutsche; Smith; Journal of the American Chemical Society; vol. 82; (1960); p. 4067,4074, View in Reaxys; Christ et al.; Helvetica Chimica Acta; vol. 44; (1961); p. 865, View in Reaxys; Patterson; Hammaker; Journal of Physical Chemistry; vol.

70; (1966); p. 3745, View in Reaxys; KAWAZOE; OHNISHI; Chemical and pharmaceutical bulletin; vol. 12; (1964); p. 846 - 848, View in Reaxys; Loots et al.; Journal of the American Chemical Society; vol. 98; (1976); p. 4571,4572, View in Reaxys; Ripoll et al.; Tetrahedron; vol. 27; (1971); p. 2431,2451, View in Reaxys; Jacobson et al.; Journal of the American Chemical Society; vol. 101; (1979); p. 6938,6943, View in Reaxys; Remane et al.; Zeitschrift fuer Chemie (Stuttgart, Germany); vol. 15; (1975); p. 312, View in Reaxys; Levin; Weingarten; Tetrahedron Letters; (1975); p. 611,613, View in Reaxys; Stothers; Lauterbur; Canadian Journal of Chemistry; vol. 42; (1964); p.

1563,1572, View in Reaxys; Marr; Stothers; Canadian Journal of Chemistry; vol. 45; (1967); p. 225,228, View in Reaxys; Tiffon; Dubois; Organic Magnetic Resonance; vol. 12; (1979); p. 24,25, View in Reaxys; Torri et al.; Bulletin de la Societe Chimique de France; (1970); p. 2167, View in Reaxys; Zimmermann et al.; Organic Magnetic Resonance; vol. 6; (1974); p. 346,348, View in Reaxys; Ichikawa; Matsuo; Bulletin of the Chemical Society of Japan; vol. 40; (1967); p. 2030,2032, View in Reaxys; Weigert; Roberts; Journal of the American Chemical Society; vol. 92; (1970); p. 1347,1348, View in Reaxys; Komoroski; Levy; Journal of Physical Chemistry; vol. 80; (1976); p.

2410, View in Reaxys; Delseth; Kintzinger; Helvetica Chimica Acta; vol. 59; (1976); p. 466, View in Reaxys; Mc Clelland; Reynolds; Canadian Journal of Chemistry; vol. 54; (1976); p. 718,721, 723, View in Reaxys; Wiberg; Nist; Journal of the American Chemical Society; vol. 83; (1961); p. 1226, View in Reaxys; Butler; Journal of the Chemical Society, Perkin Transactions 2: Physical Organic Chemistry (1972-1999); (1976); p. 959,960, 962, View in Reaxys; Kristiansen; Ledaal; Tetrahedron Letters; (1971); p. 2817,2818, View in Reaxys; Le Fevre et al.; Journal of the Chemical Society [Section] B: Physical Organic; (1968); p. 148, View in Reaxys; Ledaal; Tetrahedron Letters; (1968); p. 651, View in Reaxys; Olah; Calin; Journal of the American Chemical Society; vol. 90; (1968); p.

938, View in Reaxys; Strom et al.; Journal of Organic Chemistry; vol. 33; (1968); p. 2555, View in Reaxys

39 of 46

Description (NMR Spec- Chemical shifts troscopy) Comment (NMR Spectroscopy)

13C

Hawkes,G.E. et al.; Journal of Organic Chemistry; vol. 39; (1974); p. 1017 - 1028, View in Reaxys 40 of 46

Description (NMR Spec- Spin-spin coupling constants troscopy) Weigert; Roberts; Journal of the American Chemical Society; vol. 94; (1972); p. 6021, View in Reaxys; Ellis; Maciel; Journal of the American Chemical Society; vol. 92; (1970); p. 5829, View in Reaxys

41 of 46

Description (NMR Spec- NMR with shift reagents troscopy) Wolkowski,Z.W.; Tetrahedron Letters; (1971); p. 821 - 824, View in Reaxys; Hart; Love; Tetrahedron Letters; (1971); p. 625, View in Reaxys; Kristiansen; Ledaal; Tetrahedron Letters; (1971); p. 4457, View in Reaxys; Shapiro; Johnston; Journal of the American Chemical Society; vol. 94; (1972); p. 8185, View in Reaxys

42 of 46

Description (NMR Spec- Chemical shifts troscopy) Comment (NMR Spectroscopy)

1H

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Kristiansen; Ledaal; Tetrahedron Letters; (1971); p. 4457, View in Reaxys 43 of 46

Description (NMR Spec- Chemical shifts troscopy) Comment (NMR Spectroscopy)

der protonierten Verb. in SO2-FSO3H-SbF5

Brookhart et al.; Journal of the American Chemical Society; vol. 89; (1967); p. 1735, View in Reaxys 44 of 46

Description (NMR Spec- Chemical shifts troscopy) Savatsky et al.; Journal of Physical Chemistry; vol. 69; (1965); p. 3105, View in Reaxys

45 of 46

Description (NMR Spec- Spectrum troscopy) Comment (NMR Spectroscopy)

in Bzl.

Anet; Canadian Journal of Chemistry; vol. 39; (1961); p. 2316, View in Reaxys 46 of 46

Description (NMR Spec- Chemical shifts troscopy) Nucleus (NMR Spectroscopy)

1H

Primas et al.; Helvetica Chimica Acta; vol. 41; (1958); p. 35,37, View in Reaxys; Meyer et al.; Journal of the American Chemical Society; vol. 75; (1953); p. 4567,4570, View in Reaxys IR Spectroscopy (49) 1 of 49

Description (IR Spectroscopy)

Bands

Solvent (IR Spectroscopy)

potassium bromide

Moskalenko; Belopukhov; Ivlev; Boev; Russian Journal of Organic Chemistry; vol. 47; nb. 7; (2011); p. 1091 1096, View in Reaxys 2 of 49

Description (IR Spectroscopy)

Bands

Solvent (IR Spectroscopy)

KBr

Khazaei, Ardeshir; Sadri, Minoo; Hosseini, Hassan; Journal of the Chinese Chemical Society; vol. 54; nb. 4; (2007); p. 1011 - 1015, View in Reaxys 3 of 49

Description (IR Spectroscopy)

Spectrum

Solvent (IR Spectroscopy)

neat (no solvent)

Comment (IR Spectroscopy)

ambient temperature

Vaz, Pedro D.; Ribeiro-Claro, Paulo J.A.; Journal of Physical Chemistry A; vol. 107; nb. 32; (2003); p. 6301 - 6305, View in Reaxys 4 of 49

Description (IR Spectroscopy)

Spectrum

Solvent (IR Spectroscopy)

hexane

Temperature (IR Spectroscopy) [°C]

-40 - 20

Comment (IR Spectroscopy)

180 - 40 cm**(-1)

Alameddine, Omar K.; Journal of Molecular Structure; vol. 356; nb. 1; (1995); p. 1 - 6, View in Reaxys 5 of 49

Description (IR Spectroscopy)

Bands

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Solvent (IR Spectroscopy)

hexane

Temperature (IR Spectroscopy) [°C]

20

Comment (IR Spectroscopy)

106 cm**(-1)

Alameddine, Omar K.; Journal of Molecular Structure; vol. 356; nb. 1; (1995); p. 1 - 6, View in Reaxys 6 of 49

Description (IR Spectroscopy)

Bands

Solvent (IR Spectroscopy)

hexane

Temperature (IR Spectroscopy) [°C]

-10

Comment (IR Spectroscopy)

110 cm**(-1)

Alameddine, Omar K.; Journal of Molecular Structure; vol. 356; nb. 1; (1995); p. 1 - 6, View in Reaxys 7 of 49

Description (IR Spectroscopy)

Bands

Solvent (IR Spectroscopy)

hexane

Temperature (IR Spectroscopy) [°C]

-40

Comment (IR Spectroscopy)

115 cm**(-1)

Alameddine, Omar K.; Journal of Molecular Structure; vol. 356; nb. 1; (1995); p. 1 - 6, View in Reaxys 8 of 49

Description (IR Spectroscopy)

Bands

Solvent (IR Spectroscopy)

neat (no solvent)

Comment (IR Spectroscopy)

1747 cm**(-1)

Shipov, A. G.; Kramarova, E. P.; Artamkina, O. B.; Oleneva, G. I.; Nepomnyashchaya, N. A.; Baukov, Yu. I.; Russian Journal of General Chemistry; vol. 65; nb. 2.2; (1995); p. 233 - 240; Zhurnal Obshchei Khimii; vol. 65; nb.

2; (1995); p. 272 - 280, View in Reaxys 9 of 49

Description (IR Spectroscopy)

Spectrum

Comment (IR Spectroscopy)

332 - 80 cm**(-1)

Choo; Laane; Journal of Chemical Physics; vol. 101; nb. 4; (1994); p. 2772 - 2778, View in Reaxys 10 of 49

Description (IR Spectroscopy)

Bands

Comment (IR Spectroscopy)

239 - 79 cm**(-1)

Choo; Laane; Journal of Chemical Physics; vol. 101; nb. 4; (1994); p. 2772 - 2778, View in Reaxys 11 of 49

Description (IR Spectroscopy)

Intensity of IR bands

Boobyer; Weckherlin; Spectrochimica Acta, Part A: Molecular and Biomolecular Spectroscopy; vol. 23; (1967); p.

321, View in Reaxys; Fitzmaurice, Donald J.; Frei, Heinz; Journal of Physical Chemistry; vol. 95; nb. 7; (1991); p.

2652 - 2661, View in Reaxys 12 of 49

Description (IR Spectroscopy)

Bands

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Solvent (IR Spectroscopy)

solid matrix

Temperature (IR Spectroscopy) [°C]

-261.2

Comment (IR Spectroscopy)

2979 - 560 cm**(-1)

Fitzmaurice, Donald J.; Frei, Heinz; Journal of Physical Chemistry; vol. 95; nb. 7; (1991); p. 2652 - 2661, View in Reaxys 13 of 49

Description (IR Spectroscopy)

Spectrum

Solvent (IR Spectroscopy)

gas

Comment (IR Spectroscopy)

in the presence of gases

Chen, Xiao; Smart, Ronald B.; Applied Spectroscopy; vol. 45; nb. 8; (1991); p. 1322 - 1326, View in Reaxys 14 of 49

Description (IR Spectroscopy)

Bands

Solvent (IR Spectroscopy)

gas

Comment (IR Spectroscopy)

in the presence of gases

Chen, Xiao; Smart, Ronald B.; Applied Spectroscopy; vol. 45; nb. 8; (1991); p. 1322 - 1326, View in Reaxys 15 of 49

Description (IR Spectroscopy)

Bands

Solvent (IR Spectroscopy)

neat (no solvent)

Comment (IR Spectroscopy)

2968 - 836 cm**(-1)

Jedlinski; Misioiek; Giowkowski; Janeczek; Wolinska; Tetrahedron; vol. 46; nb. 10; (1990); p. 3547 - 3558, View in Reaxys 16 of 49

Description (IR Spectroscopy)

Bands

Comment (IR Spectroscopy)

1727 cm**(-1)

Starostin, E. K.; Aleksandrov, A. V.; Shchetinin, S. V.; Gushchin, V. V.; Nikishin, G. I.; Bulletin of the Academy of Sciences of the USSR, Division of Chemical Science (English Translation); vol. 38; nb. 1.1; (1989); p. 93 - 95; Izvestiya Akademii Nauk SSSR, Seriya Khimicheskaya; nb. 1; (1989); p. 106 - 108, View in Reaxys 17 of 49

Description (IR Spectroscopy)

Bands

Solvent (IR Spectroscopy)

neat (no solvent)

Comment (IR Spectroscopy)

1746 cm**(-1)

Kolb, Vera M.; Stupar, Joseph W.; Janota, Timothy E.; Duax, William L.; Journal of Organic Chemistry; vol. 54; nb. 10; (1989); p. 2341 - 2346, View in Reaxys 18 of 49

Description (IR Spectroscopy)

Bands

Solvent (IR Spectroscopy)

neat (no solvent)

Comment (IR Spectroscopy)

2960 - 830 cm**(-1)

Mitra, R. B.; Reddy, G. Bhaskar; Synthesis; nb. 9; (1989); p. 694 - 698, View in Reaxys

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19 of 49

Description (IR Spectroscopy)

Bands

Solvent (IR Spectroscopy)

neat (no solvent)

Comment (IR Spectroscopy)

1722 cm**(-1)

'Femi-Onadeko, Bankole; Acta Chimica Hungarica; vol. 122; nb. 2; (1986); p. 175 - 180, View in Reaxys 20 of 49

Description (IR Spectroscopy)

Bands

Comment (IR Spectroscopy)

1752 cm**(-1)

Yatsenko-Khmelevskaya, M. A.; Bedrina, M. E.; Sverdlova, O. V.; J. Gen. Chem. USSR (Engl. Transl.); vol. 56; nb. 11; (1986); p. 2565 - 2567,2269 - 2271, View in Reaxys 21 of 49

Description (IR Spectroscopy)

Bands

Solvent (IR Spectroscopy)

various solvent(s)

Comment (IR Spectroscopy)

1992 - 1920 cm**(-1)

Saunders, David R.; Mawby, Roger J.; Journal of the Chemical Society, Dalton Transactions: Inorganic Chemistry (1972-1999); (1984); p. 2133 - 2136, View in Reaxys 22 of 49

Description (IR Spectroscopy)

Bands

Solvent (IR Spectroscopy)

neat (no solvent)

Comment (IR Spectroscopy)

1745 cm**(-1)

Ogawa; Fujinami; Taya; Teratani; Bulletin of the Chemical Society of Japan; vol. 57; nb. 7; (1984); p. 1908 - 1913, View in Reaxys 23 of 49

Description (IR Spectroscopy)

Bands

Solvent (IR Spectroscopy)

benzene

Comment (IR Spectroscopy)

1748 - 471 cm**(-1)

Bertran, Jose Fernandez; Ballester, Lourdes; Spectrochimica Acta, Part A: Molecular and Biomolecular Spectroscopy; vol. 39; nb. 2; (1983); p. 123 - 126, View in Reaxys 24 of 49

Description (IR Spectroscopy)

Bands

Solvent (IR Spectroscopy)

hexane

Comment (IR Spectroscopy)

1754 - 472 cm**(-1)

Bertran, Jose Fernandez; Ballester, Lourdes; Spectrochimica Acta, Part A: Molecular and Biomolecular Spectroscopy; vol. 39; nb. 2; (1983); p. 123 - 126, View in Reaxys 25 of 49

Description (IR Spectroscopy)

Bands

Solvent (IR Spectroscopy)

acetonitrile

Comment (IR Spectroscopy)

1747 - 475 cm**(-1)

Bertran, Jose Fernandez; Ballester, Lourdes; Spectrochimica Acta, Part A: Molecular and Biomolecular Spectroscopy; vol. 39; nb. 2; (1983); p. 123 - 126, View in Reaxys

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26 of 49

Description (IR Spectroscopy)

Bands

Solvent (IR Spectroscopy)

CHCl3

Comment (IR Spectroscopy)

1745 - 474 cm**(-1)

Bertran, Jose Fernandez; Ballester, Lourdes; Spectrochimica Acta, Part A: Molecular and Biomolecular Spectroscopy; vol. 39; nb. 2; (1983); p. 123 - 126, View in Reaxys 27 of 49

Description (IR Spectroscopy)

Bands

Solvent (IR Spectroscopy)

CH2Cl2

Comment (IR Spectroscopy)

1745 - 474 cm**(-1)

Bertran, Jose Fernandez; Ballester, Lourdes; Spectrochimica Acta, Part A: Molecular and Biomolecular Spectroscopy; vol. 39; nb. 2; (1983); p. 123 - 126, View in Reaxys 28 of 49

Description (IR Spectroscopy)

Bands

Solvent (IR Spectroscopy)

CCl4

Comment (IR Spectroscopy)

1753 - 473 cm**(-1)

Bertran, Jose Fernandez; Ballester, Lourdes; Spectrochimica Acta, Part A: Molecular and Biomolecular Spectroscopy; vol. 39; nb. 2; (1983); p. 123 - 126, View in Reaxys 29 of 49

Description (IR Spectroscopy)

Bands

Solvent (IR Spectroscopy)

neat (no solvent)

Comment (IR Spectroscopy)

1748 - 473 cm**(-1)

Bertran, Jose Fernandez; Ballester, Lourdes; Spectrochimica Acta, Part A: Molecular and Biomolecular Spectroscopy; vol. 39; nb. 2; (1983); p. 123 - 126, View in Reaxys 30 of 49

Description (IR Spectroscopy)

Bands

Solvent (IR Spectroscopy)

tetrachloroethene

Comment (IR Spectroscopy)

1752 - 472 cm**(-1)

Bertran, Jose Fernandez; Ballester, Lourdes; Spectrochimica Acta, Part A: Molecular and Biomolecular Spectroscopy; vol. 39; nb. 2; (1983); p. 123 - 126, View in Reaxys 31 of 49

Description (IR Spectroscopy)

Bands

Solvent (IR Spectroscopy)

CS2

Comment (IR Spectroscopy)

1749 - 471 cm**(-1)

Bertran, Jose Fernandez; Ballester, Lourdes; Spectrochimica Acta, Part A: Molecular and Biomolecular Spectroscopy; vol. 39; nb. 2; (1983); p. 123 - 126, View in Reaxys 32 of 49

Description (IR Spectroscopy)

Bands

Solvent (IR Spectroscopy)

CHBr3

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Comment (IR Spectroscopy)

1743 - 474 cm**(-1)

Bertran, Jose Fernandez; Ballester, Lourdes; Spectrochimica Acta, Part A: Molecular and Biomolecular Spectroscopy; vol. 39; nb. 2; (1983); p. 123 - 126, View in Reaxys 33 of 49

Description (IR Spectroscopy)

Spectrum

Temperature (IR Spectroscopy) [°C]

80

Comment (IR Spectroscopy)

2000 - 1500 cm**(-1)

Takagi, H.; Washida, N.; Banbow, H.; Akimoto, H.; Okuda, M.; Journal of Physical Chemistry; vol. 85; nb. 18; (1981); p. 2701 - 2705, View in Reaxys 34 of 49

Description (IR Spectroscopy)

Bands

Solvent (IR Spectroscopy)

acetonitrile

Comment (IR Spectroscopy)

1746 cm**(-1)

Borsdorf, Rolf; Remane, Horst; Journal fuer Praktische Chemie (Leipzig); vol. 322; nb. 1; (1980); p. 152 - 154, View in Reaxys 35 of 49

Description (IR Spectroscopy)

Bands

Solvent (IR Spectroscopy)

CCl4

Comment (IR Spectroscopy)

1748 cm**(-1)

Borsdorf, Rolf; Remane, Horst; Journal fuer Praktische Chemie (Leipzig); vol. 322; nb. 1; (1980); p. 152 - 154, View in Reaxys 36 of 49

Description (IR Spectroscopy)

IR

Hartke,K.; Wachsen,E.; Justus Liebigs Annalen der Chemie; (1976); p. 730 - 744, View in Reaxys; Fraisse-Jullien,R.; Frejaville,C.; Bulletin de la Societe Chimique de France; (1970); p. 219 - 230, View in Reaxys; de Botton,M.; Bulletin de la Societe Chimique de France; (1975); p. 1773 - 1776, View in Reaxys; Ogibin; Troyanskii; Nikishin; Bulletin of the Academy of Sciences of the USSR Division of Chemical Science; vol. 26; nb. 4; (1977); p.

767 - 771, View in Reaxys; Fayat; Foucaud; Bulletin de la Societe Chimique de France; (1970); p. 4491,4492-4494, View in Reaxys; Welti; Stephany; Applied Spectroscopy; vol. 22; (1968); p. 678,686, View in Reaxys; Alencastro; Canadian Journal of Chemistry; vol. 52; (1974); p. 738,739, View in Reaxys; Cook; Canadian Journal of Chemistry; vol. 39; (1961); p. 31, View in Reaxys; Durig et al.; Journal of Molecular Spectroscopy; vol. 27; (1968); p. 285, View in Reaxys; de Botton; Comptes Rendus des Seances de l'Academie des Sciences, Serie C: Sciences Chimiques; vol. 272; (1971); p. 118, View in Reaxys; Viel et al.; Bulletin de la Societe Chimique de France; (1966); p.

1104, View in Reaxys; Pagliardini et al.; Tetrahedron Letters; (1972); p. 4241,4242, View in Reaxys; Granger et al.; Bulletin de la Societe Chimique de France; (1971); p. 4458,4459,4460,4461,4462, View in Reaxys; Dabral et al.; Tetrahedron Letters; (1975); p. 4681, View in Reaxys; Festal et al.; Bulletin de la Societe Chimique de France; (1970); p. 2943,2946, View in Reaxys; Guimon et al.; Journal of Molecular Structure; vol. 33; (1976); p.

239,240,243,247, View in Reaxys; Darre et al.; Bulletin de la Societe Chimique de France; (1975); p. 829, View in Reaxys; Howard-Lock; King; Journal of Molecular Spectroscopy; vol. 35; (1970); p. 393, View in Reaxys; Buzzi et al.; Journal of the Chemical Society, Perkin Transactions 2: Physical Organic Chemistry (1972-1999); (1975); p. 1294, View in Reaxys; Rao et al.; Journal of the Indian Institute of Science; vol. 43; (1961); p. 10, View in Reaxys; Galabov; Simov; Chemical Physics Letters; vol. 5; (1970); p. 549, View in Reaxys; Ginzburg; Khlevnyuk; Optics and Spectroscopy; vol. 26; (1969); p. 98; ; p. 183, View in Reaxys; Ginzburg; Khlevnyuk; Optics and Spectroscopy; vol. 31; (1971); p. 169; ; p. 313, View in Reaxys; Kartha et al.; Canadian Journal of Chemistry; vol. 51; (1973); p. 1749,1754, View in Reaxys; Granger et al.; Bulletin de la Societe Chimique de France; (1971); p. 1771,1774, View in Reaxys; Brooks et al.; Journal of the Chemical Society; (1961); p. 106,108, View in Reaxys; Baker; Spectrochimica Acta; vol. 21; (1965); p. 1603, View in Reaxys; Chadwick et al.; Tetrahedron Letters; (1971); p. 4543, View in Reaxys; Chiurdoglu et al.; Tetrahedron Letters; (1963); p. 1577,1579, View in Reaxys; Sablayrolles et al.; Journal de Chimie Physique et de Physico-Chimie Biologique; vol. 66; (1969); p. 1139, View in Reaxys 37 of 49

Description (IR Spectroscopy)

Spectrum

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Katon,J.E.; Bentley,F.F.; Spectrochimica Acta; vol. 19; (1963); p. 639 - 653, View in Reaxys; Bellamy,L.J.; Pace,R.J.; Spectrochimica Acta; vol. 19; (1963); p. 1831 - 1839, View in Reaxys; Hartwell; Richards; Thompson; Journal of the Chemical Society; (1948); p. 1437, View in Reaxys; Chiurdoglu; Barchewitz; Freymann; Bulletin des Societes Chimiques Belges; vol. 47; (1938); p. 448,450, 460, View in Reaxys; Freymann; Freymann; Group. franc. Rech. aeronaut.; Note tech. Nr. 11 <1943>, View in Reaxys; Lecomte; Chiurdoglu; Bulletin des Societes Chimiques Belges; vol. 47; (1938); p. 429,434, 447, View in Reaxys; Carreira; Lord; Journal of Chemical Physics; vol.

51; (1969); p. 3225,3226, View in Reaxys; Wood; Buckingham; Spectrochimica Acta, Part A: Molecular and Biomolecular Spectroscopy; vol. 26; (1970); p. 465,468, View in Reaxys; Allen et al.; Journal of the Chemical Society; (1960); p. 1909,1911, View in Reaxys; Gramstad; Spectrochimica Acta; vol. 19; (1963); p. 497,499, View in Reaxys; Weinman et al.; Comptes Rendus des Seances de l'Academie des Sciences, Serie C: Sciences Chimiques; vol.

275; (1972); p. 861, View in Reaxys; Weinmann et al.; Canadian Journal of Chemistry; vol. 54; (1976); p. 31, View in Reaxys; Ikeda; Lord; Journal of Chemical Physics; vol. 56; (1972); p. 4450, View in Reaxys; Cataliotti; Paliani; Chemical Physics Letters; vol. 20; (1973); p. 280, View in Reaxys; Cataliotti; Jones; Spectrochimica Acta, Part A: Molecular and Biomolecular Spectroscopy; vol. 27; (1971); p. 2011, View in Reaxys; Buerer; Guenthard; Helvetica Chimica Acta; vol. 43; (1960); p. 1487,1489, View in Reaxys; Wahlroos; Enkvist; Acta Chemica Scandinavica (1947-1973); vol. 22; (1968); p. 3202,3206, View in Reaxys 38 of 49

Description (IR Spectroscopy)

Fermi resonance

Davis; Kim; Theoretica Chimica Acta; vol. 25; (1972); p. 89, View in Reaxys; Bertran et al.; Spectrochimica Acta, Part A: Molecular and Biomolecular Spectroscopy; vol. 24; (1968); p. 1765,1771, View in Reaxys 39 of 49

Description (IR Spectroscopy)

Bands

Schleyer,P. von R.; Nicholas,R.D.; Journal of the American Chemical Society; vol. 83; (1961); p. 182 - 187, View in Reaxys; Zbinden; Hall; Journal of the American Chemical Society; vol. 82; (1960); p. 1215, View in Reaxys; Cetina; Mateos; Journal of Organic Chemistry; vol. 25; (1960); p. 704,706, View in Reaxys; Wiberg; Nist; Journal of the American Chemical Society; vol. 83; (1961); p. 1226, View in Reaxys; Bertran et al.; Spectrochimica Acta, Part A: Molecular and Biomolecular Spectroscopy; vol. 24; (1968); p. 1765,1771, View in Reaxys; Dang-QuocQuan; Comptes Rendus des Seances de l'Academie des Sciences, Serie C: Sciences Chimiques; vol. 262; (1966); p. 924, View in Reaxys; Brauman; Laurie; Tetrahedron; vol. 24; (1968); p. 2595, View in Reaxys 40 of 49

Description (IR Spectroscopy)

Spectrum

Solvent (IR Spectroscopy)

neat (no solvent)

Comment (IR Spectroscopy)

4000 - 606 cm**(-1); fluessiges Cyclopentanon.

Angell et al.; Spectrochimica Acta; vol. 15; (1959); p. 926,929, View in Reaxys; Buerer; Guenthard; Helvetica Chimica Acta; vol. 40; (1957); p. 2054,2058, View in Reaxys 41 of 49

Description (IR Spectroscopy)

Intensity of IR bands

Comment (IR Spectroscopy)

Intensitaet und Halbwertsbreite der CO-Valenzschwingungsbande von in CCl4 geloestem Cyclopropanon.

Thompson; Jameson; Spectrochimica Acta; vol. 13; (1959); p. 236,238, View in Reaxys; Buerer; Guenthard; Helvetica Chimica Acta; vol. 39; (1956); p. 356,362, View in Reaxys 42 of 49

Description (IR Spectroscopy)

Bands

Solvent (IR Spectroscopy)

CHCl3

Comment (IR Spectroscopy)

Bereich der CO-Valenzschwingungsbande.

Depireux; Bulletin des Societes Chimiques Belges; vol. 66; (1957); p. 218,221, View in Reaxys; Castinel et al.; Bulletin de la Societe Chimique de France; (1958); p. 807,808, View in Reaxys 43 of 49

Description (IR Spectroscopy)

Bands

Solvent (IR Spectroscopy)

neat (no solvent)

Comment (IR Spectroscopy)

Bereich der CO-Valenzschwingungsbande.

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Depireux; Bulletin des Societes Chimiques Belges; vol. 66; (1957); p. 218,221, View in Reaxys; Castinel et al.; Bulletin de la Societe Chimique de France; (1958); p. 807,808, View in Reaxys 44 of 49

Description (IR Spectroscopy)

Bands

Solvent (IR Spectroscopy)

CCl4

Comment (IR Spectroscopy)

Bereich der CO-Valenzschwingungsbande.

Depireux; Bulletin des Societes Chimiques Belges; vol. 66; (1957); p. 218,221, View in Reaxys; Castinel et al.; Bulletin de la Societe Chimique de France; (1958); p. 807,808, View in Reaxys 45 of 49

Description (IR Spectroscopy)

Bands

Solvent (IR Spectroscopy)

neat (no solvent)

Comment (IR Spectroscopy)

Dampf. Bereich der CO-Valenzschwingungsbande.

Depireux; Bulletin des Societes Chimiques Belges; vol. 66; (1957); p. 218,221, View in Reaxys; Castinel et al.; Bulletin de la Societe Chimique de France; (1958); p. 807,808, View in Reaxys 46 of 49

Description (IR Spectroscopy)

Spectrum

Solvent (IR Spectroscopy)

CS2

Comment (IR Spectroscopy)

5000 - 667 cm**(-1)

Schulte; Hanssen; Archiv der Pharmazie (Weinheim, Germany); vol. 290; (1957); p. 97,105, View in Reaxys 47 of 49

Description (IR Spectroscopy)

Spectrum

Solvent (IR Spectroscopy)

neat (no solvent)

Comment (IR Spectroscopy)

4000 - 606 cm**(-1); festes Cyclopentanon bei -180grad.

Buerer; Guenthard; Helvetica Chimica Acta; vol. 40; (1957); p. 2054,2058, View in Reaxys 48 of 49

Description (IR Spectroscopy)

Spectrum

Solvent (IR Spectroscopy)

neat (no solvent)

Comment (IR Spectroscopy)

10000 - 667 cm**(-1); fluessiges Cyclopentanon.

Mecke et al.; Chemische Berichte; vol. 90; (1957); p. 975,977, View in Reaxys 49 of 49

Description (IR Spectroscopy)

Intensity of IR bands

Comment (IR Spectroscopy)

Einfluss von CCl4, Chlorbenzol, Cyclopentanol, Benzaldehyd und Methanol auf die Lage und Intensitaet der CO-Valenzschwingungsbande.

Suetaka; Nippon Kagaku Zasshi; vol. 74; (1953); p. 318,319; Chem.Abstr.; (1954); p. 450, View in Reaxys; Suetaka; Gazzetta Chimica Italiana; vol. 82; (1952); p. 768,770, View in Reaxys Mass Spectrometry (12) Description (Mass Location Spectrometry)

Comment (Mass Spectrometry)

GCMS (Gas chromatography mass spectrometry); Spectrum

Copyright © 2017 Reed Elsevier Properties SA. All rights reserved. Authorized use only. Reaxys® and the Reaxys® trademark are owned and protected by Reed Elsevier Properties SA and used under license.

References Moskalenko; Belopukhov; Ivlev; Boev; Russian Journal of Organic Chemistry; vol. 47; nb. 7; (2011); p. 1091 - 1096, View in Reaxys; Landwehr, Anne; Dudle, Balz; Fox, Thomas; Blacque, Olivier; Berke, Heinz; Chemistry - A European Journal; vol. 18; nb. 18; (2012); p. 5701 - 5714, View in Reaxys

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EI (Electron impact); Spectrum

supporting information

Lakshmi Kantam; Arundhathi; Likhar, Pravin R.; Damodara; Advanced Synthesis and Catalysis; vol. 351; nb. 16; (2009); p. 2633 2637, View in Reaxys

fragmentation pattern; collisioninduced dissociation

Ahmad, Mohammad R.; Kass, Steven R.; Australian Journal of Chemistry; vol. 56; nb. 5; (2003); p. 453 - 458, View in Reaxys

time-of-flight mass spectra (TOFMS); fragmentation pattern

Kosmidis; Philis; Tzallas; Physical Chemistry Chemical Physics; vol. 1; nb. 12; (1999); p. 2945 - 2948, View in Reaxys

spectrum; time-offlight mass spectra (TOFMS)

Kosmidis; Tzallas; Ledingham; McCanny; Singhal; Taday; Langley; Journal of Physical Chemistry A; vol. 103; nb. 35; (1999); p.

6950 - 6955, View in Reaxys

spectrum; electron impact (EI)

Bonhote, Pierre; Scheffold, Rolf; Helvetica Chimica Acta; vol. 74; nb. 7; (1991); p. 1425 - 1444, View in Reaxys

spectrum

Traeger, John C.; Hudson, Charles E.; McAdoo, David J.; Organic Mass Spectrometry; vol. 24; (1989); p. 230 - 234, View in Reaxys; Ogawa; Fujinami; Taya; Teratani; Bulletin of the Chemical Society of Japan; vol. 57; nb. 7; (1984); p. 1908 - 1913, View in Reaxys

ion-cyclotron resonance

Hass et al.; Organic Mass Spectrometry; vol. 11; (1976); p. 697,701, View in Reaxys; Bouchoux, G.; Houriet, R.; Tetrahedron Letters; vol. 25; nb. 50; (1984); p. 5755 - 5758, View in Reaxys

spectrum

MIKE (mass ion kinetic energy); metastable ions

Maquestiau, A.; Flammang, R.; Pauwels, P.; Organic Mass Spectrometry; vol. 18; nb. 12; (1983); p. 547 - 552, View in Reaxys

chemical ionization (CI); spectrum

Keough, T.; Analytical Chemistry; vol. 54; nb. 14; (1982); p. 2540 2547, View in Reaxys

chemical ionization (CI)

IKE(S) (ion kinetic Maquestiau, Andre; Flammang, Robert; Nielsen, Lawrence; Orenergy (specganic Mass Spectrometry; vol. 15; nb. 7; (1980); p. 376 - 379, trum)) View in Reaxys Molton,P.M. et al.; Carbohydrate Research; vol. 75; (1979); p. 199 206, View in Reaxys; Sharkey et al.; Analytical Chemistry; vol. 28; (1956); p. 934,936,938, View in Reaxys; Natalis; Bulletin des Societes Chimiques Belges; vol. 67; (1958); p. 599,600, View in Reaxys; Mussinan; Walradt; Journal of Agricultural and Food Chemistry; vol.

22; (1974); p. 827,830, View in Reaxys; Ferretti; Flanagan; Journal of Agricultural and Food Chemistry; vol. 19; (1971); p. 245,247, View in Reaxys; Samchenko et al.; Theoretical and Experimental Chemistry; vol. 14; (1978); p. 537; ; p. 688, View in Reaxys; Olmsted et al.; Journal of Chemical Physics; vol. 40; (1964); p.

2114,2116, View in Reaxys; Allen et al.; Journal of the Chemical Society; (1960); p. 1909,1911, View in Reaxys; Aplin et al.; Journal of the American Chemical Society; vol. 87; (1965); p. 3180,3182, View in Reaxys; Sigsby et al.; Organic Mass Spectrometry; vol. 14; (1979); p. 273,276, View in Reaxys; Samchenko; Nazarenko; Grom; Aleksankin; Theoretical and Experimental Chemistry; vol.

12; nb. 3; (1976); p. 317 - 322, View in Reaxys; Hass et al.; Organic Mass Spectrometry; vol. 11; (1976); p. 697,701, View in Reaxys; Beynon et al.; Applied Spectroscopy; vol. 14; (1960); p. 95,96,97; Chem.Abstr.; nb. 20464; (1960), View in Reaxys; Wahlroos; Enkvist; Acta Chemica Scandinavica (1947-1973); vol. 22; (1968); p.

3202,3206, View in Reaxys

UV/VIS Spectroscopy (30) 1 of 30

Description (UV/VIS Spectroscopy)

Band assignment; Spectrum

Lepelmeier, Jörn; Titze, Katharina; Kartouzian, Aras; Boesl, Ulrich; Heiz, Ulrich; ChemPhysChem; vol. 17; nb.

24; (2016); p. 4052 - 4058, View in Reaxys 2 of 30

Description (UV/VIS Spectroscopy)

Spectrum

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Solvent (UV/VIS Spectroscopy)

gaseous matrix

Comment (UV/VIS Spectroscopy)

200.8 - 194.93 nm

Potts, Alan R.; Baer, Tomas; Journal of Physical Chemistry A; vol. 101; nb. 48; (1997); p. 8970 - 8978, View in Reaxys 3 of 30

Description (UV/VIS Spectroscopy)

Spectrum

Comment (UV/VIS Spectroscopy)

175 - 185 nm

Kosmidis, C.; Boulakis, G.; Bolovinos, A.; Tsekeris, P.; Brint, P.; Journal of Molecular Structure; vol. 266; nb. 1; (1992); p. 133 - 140, View in Reaxys 4 of 30

Description (UV/VIS Spectroscopy)

Oscillator strength

O'Toole, Liam; Brint, Paul; Kosmidis, Constantine; Boulakis, George; Tsekeris, Pericles; Journal of the Chemical Society, Faraday Transactions; vol. 87; nb. 20; (1991); p. 3343 - 3352, View in Reaxys; O'Toole, Liam; Brint, Paul; Kosmidis, Constantine; Boulakis, George; Bolovinos, Agisilaos; Journal of the Chemical Society, Faraday Transactions; vol. 88; nb. 9; (1992); p. 1237 - 1244, View in Reaxys; Shibuya, Tai-ichi; Bulletin of the Chemical Society of Japan; vol. 57; nb. 10; (1984); p. 2991 - 2992, View in Reaxys 5 of 30

Description (UV/VIS Spectroscopy)

Spectrum

Comment (UV/VIS Spectroscopy)

140 - 200 nm

O'Toole, Liam; Brint, Paul; Kosmidis, Constantine; Boulakis, George; Tsekeris, Pericles; Journal of the Chemical Society, Faraday Transactions; vol. 87; nb. 20; (1991); p. 3343 - 3352, View in Reaxys 6 of 30

Description (UV/VIS Spectroscopy)

Vacuum-UV spectrum

O'Toole, Liam; Brint, Paul; Kosmidis, Constantine; Boulakis, George; Tsekeris, Pericles; Journal of the Chemical Society, Faraday Transactions; vol. 87; nb. 20; (1991); p. 3343 - 3352, View in Reaxys 7 of 30

Description (UV/VIS Spectroscopy)

Absorption maxima

Absorption Maxima (UV/ 199.73 VIS) [nm] Cornish, Timothy J.; Baer, Tomas; Journal of the American Chemical Society; vol. 109; nb. 23; (1987); p. 6915 6920, View in Reaxys 8 of 30

Description (UV/VIS Spectroscopy)

Absorption maxima

Solvent (UV/VIS Spectroscopy)

cyclohexane

Absorption Maxima (UV/ 300 VIS) [nm] Ext./Abs. Coefficient [l·mol-1cm-1]

19

Veen, Reinout H, Van Der; Cerfontain, Hans; Tetrahedron; vol. 41; nb. 3; (1985); p. 585 - 594, View in Reaxys 9 of 30

Description (UV/VIS Spectroscopy)

Absorption maxima

Solvent (UV/VIS Spectroscopy)

cyclohexane

Absorption Maxima (UV/ 324; 312; 300; 289 VIS) [nm] Ext./Abs. Coefficient [l·mol-1cm-1]

7; 15; 19; 18

Veen, Reinout H, Van Der; Cerfontain, Hans; Tetrahedron; vol. 41; nb. 3; (1985); p. 585 - 594, View in Reaxys

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10 of 30

Description (UV/VIS Spectroscopy)

Absorption maxima

Solvent (UV/VIS Spectroscopy)

cyclohexane

Absorption Maxima (UV/ 325; 312; 300; 289 VIS) [nm] Ext./Abs. Coefficient [l·mol-1cm-1]

7; 15; 19; 18

Koppes, Margareth J. C. M.; Cerfontain, Hans; Recueil des Travaux Chimiques des Pays-Bas; vol. 104; nb. 10; (1985); p. 272 - 276, View in Reaxys 11 of 30

Description (UV/VIS Spectroscopy)

Spectrum

Solvent (UV/VIS Spectroscopy)

cyclohexane

Comment (UV/VIS Spectroscopy)

250 - 320 nm

Meal, Larie.; Analytical Chemistry; vol. 55; (1983); p. 2448 - 2450, View in Reaxys 12 of 30

Description (UV/VIS Spectroscopy)

Absorption maxima

Solvent (UV/VIS Spectroscopy)

cyclohexane

Absorption Maxima (UV/ 300 VIS) [nm] Meal, Larie.; Analytical Chemistry; vol. 55; (1983); p. 2448 - 2450, View in Reaxys 13 of 30

Description (UV/VIS Spectroscopy)

Absorption maxima

Solvent (UV/VIS Spectroscopy)

heptane

Absorption Maxima (UV/ 300 VIS) [nm] Stumpe, J.; Schwetlick, K.; Kuzmin, M. G.; Journal fuer Praktische Chemie (Leipzig); vol. 324; nb. 3; (1982); p.

400 - 408, View in Reaxys 14 of 30

Description (UV/VIS Spectroscopy)

Spectrum

Solvent (UV/VIS Spectroscopy)

ethanol

Comment (UV/VIS Spectroscopy)

333.33 - 200 nm

Shcheglova, N. A.; Shigorin, D. N.; Lesnenko, L. G.; Russian Journal of Physical Chemistry; vol. 55; nb. 1; (1981); p. 69 - 72; Zhurnal Fizicheskoi Khimii; vol. 55; nb. 1; (1981); p. 133 - 137, View in Reaxys 15 of 30

Description (UV/VIS Spectroscopy)

Spectrum

Solvent (UV/VIS Spectroscopy)

2-methyl-butane

Comment (UV/VIS Spectroscopy)

333.33 - 200 nm

Shcheglova, N. A.; Shigorin, D. N.; Lesnenko, L. G.; Russian Journal of Physical Chemistry; vol. 55; nb. 1; (1981); p. 69 - 72; Zhurnal Fizicheskoi Khimii; vol. 55; nb. 1; (1981); p. 133 - 137, View in Reaxys 16 of 30

Description (UV/VIS Spectroscopy)

Spectrum

Comment (UV/VIS Spectroscopy)

187 - 205 nm

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Causley, G. C.; Russell, B. R.; Journal of Chemical Physics; vol. 72; nb. 4; (1980); p. 2623 - 2631, View in Reaxys 17 of 30

Description (UV/VIS Spectroscopy)

UV/VIS

Mason; Molecular Physics; vol. 5; (1962); p. 343, View in Reaxys; Closson; Haug; Journal of the American Chemical Society; vol. 86; (1964); p. 2384,2389, View in Reaxys; Cosse-Barbi; Dubois; Spectrochimica Acta, Part A: Molecular and Biomolecular Spectroscopy; vol. 28; (1972); p. 539, View in Reaxys; Gallado-Herrero et al.; Comptes Rendus des Seances de l'Academie des Sciences, Serie C: Sciences Chimiques; vol. 275; (1972); p. 1319, View in Reaxys; Rao et al.; Journal of the Indian Institute of Science; vol. 43; (1961); p. 10, View in Reaxys; Gallardo-Herrero et al.; Tetrahedron Letters; (1972); p. 4553,4554, View in Reaxys; Vidal; Decock; Comptes Rendus des Seances de l'Academie des Sciences, Serie C: Sciences Chimiques; vol. 279; (1974); p. 145,146,147, View in Reaxys; Prugger; Doerr; Zeitschrift fuer Elektrochemie; vol. 64; (1960); p. 425; Chem.Abstr.; vol. 54; nb.

13855; (1960), View in Reaxys; Uekama et al.; Chemistry Letters; (1977); p. 1389,1390, View in Reaxys 18 of 30

Description (UV/VIS Spectroscopy)

Spectrum

Cantacuzene,J.; Bulletin de la Societe Chimique de France; (1962); p. 741 - 747, View in Reaxys; Lee et al.; Journal of Physical Chemistry; vol. 73; (1969); p. 1805, View in Reaxys; Horwood; Williams; Spectrochimica Acta; vol.

19; (1963); p. 1351,1358, View in Reaxys; O'Sullivan; Testa; Journal of Physical Chemistry; vol. 77; (1973); p.

1830, View in Reaxys; Howard-Lock; King; Journal of Molecular Spectroscopy; vol. 36; (1970); p. 53,54-76, View in Reaxys; Gallardo-Herrero et al.; Bulletin de la Societe Chimique de France; (1973); p. 2231,2232, View in Reaxys; Kazakova et al.; J. Appl. Chem. USSR (Engl. Transl.); vol. 46; (1973); p. 1880,2008, View in Reaxys; Chandler; Goodman; Journal of Molecular Spectroscopy; vol. 35; (1970); p. 232,236, View in Reaxys; Molina; Lee; Journal of Physical Chemistry; vol. 80; (1976); p. 244,245, View in Reaxys; Udvarhazi; El-Sayed; Journal of Chemical Physics; vol. 42; (1965); p. 3335, View in Reaxys; Witz; Ourisson; Bulletin de la Societe Chimique de France; (1964); p. 627, View in Reaxys; Dang Quoc Quan; Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences; vol. 261; (1965); p. 2374, View in Reaxys; Prugger; Doerr; Zeitschrift fuer Elektrochemie; vol. 64; (1960); p. 425; Chem.Abstr.; vol. 54; nb. 13855; (1960), View in Reaxys; Tori; Chemical and Pharmaceutical Bulletin; vol. 12; (1964); p. 1439,1442, 1444-1446, View in Reaxys 19 of 30

Description (UV/VIS Spectroscopy)

Absorption maxima

Fiarman,I.D.; Gettler,J.D.; Journal of the American Chemical Society; vol. 84; (1962); p. 961 - 966, View in Reaxys; Bell,J.M. et al.; Journal of Organic Chemistry; vol. 30; (1965); p. 4284 - 4292, View in Reaxys; Kosower; Wu; Journal of the American Chemical Society; vol. 83; (1961); p. 3146, View in Reaxys; Mountcastle et al.; Journal of Physical Chemistry; vol. 64; (1960); p. 1342, View in Reaxys; Campbell; Edward; Canadian Journal of Chemistry; vol. 38; (1960); p. 2109,2111, View in Reaxys; Jones; Bender; Journal of the American Chemical Society; vol. 82; (1960); p. 6322, View in Reaxys; Hayes; Timmons; Spectrochimica Acta; vol. 21; (1965); p. 529,535, View in Reaxys; Gallardo-Herrero et al.; Bulletin de la Societe Chimique de France; (1973); p. 881,883, View in Reaxys; Seamans et al.; Journal of the American Chemical Society; vol. 94; (1972); p. 6464,6472,6473, View in Reaxys; Dang Quoc Quan; Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences; vol. 261; (1965); p. 2374, View in Reaxys; Dang-Quoc-Quan; Comptes Rendus des Seances de l'Academie des Sciences, Serie C: Sciences Chimiques; vol. 262; (1966); p. 924, View in Reaxys 20 of 30

Description (UV/VIS Spectroscopy)

Spectrum

Comment (UV/VIS Spectroscopy)

des Dampfes.

Scheibe; Grieneisen; Zeitschrift fuer Physikalische Chemie (Leipzig); vol. <B> 25; (1934); p. 52,55, View in Reaxys; Lestrade; Thouvenin; Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences; vol. 234; (1952); p. 2183, View in Reaxys; Horwood; Williams; Spectrochimica Acta; vol. 19; (1963); p.

1351,1358, View in Reaxys; Prugger; Doerr; Zeitschrift fuer Elektrochemie und Angewandte Physikalische Chemie; vol. 64; (1960); p. 425; Chem.Abstr.; vol. 54; nb. 13855; (1960), View in Reaxys 21 of 30

Description (UV/VIS Spectroscopy)

Spectrum

Solvent (UV/VIS Spectroscopy)

methylcyclohexane / pentane

Comment (UV/VIS Spectroscopy)

210 - 330 nm

Doerr; Zeitschrift fuer Elektrochemie und Angewandte Physikalische Chemie; vol. 61; (1957); p. 950,951, View in Reaxys 22 of 30

Description (UV/VIS Spectroscopy)

Spectrum

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Comment (UV/VIS Spectroscopy)

Feinstruktur des Spektrums.

Rao et al.; Journal of Scientific and Industrial Research; vol. 16 B; (1957); p. 388, View in Reaxys 23 of 30

Description (UV/VIS Spectroscopy)

Spectrum

Solvent (UV/VIS Spectroscopy)

ethanol

Comment (UV/VIS Spectroscopy)

210 - 330 nm; bei -173grad.

Doerr; Zeitschrift fuer Elektrochemie und Angewandte Physikalische Chemie; vol. 61; (1957); p. 950,951, View in Reaxys 24 of 30

Description (UV/VIS Spectroscopy)

Spectrum

Solvent (UV/VIS Spectroscopy)

heptane

Comment (UV/VIS Spectroscopy)

230 - 330 nm

Kumler; Huitric; Journal of the American Chemical Society; vol. 78; (1956); p. 3369,3371, View in Reaxys 25 of 30

Description (UV/VIS Spectroscopy)

Spectrum

Solvent (UV/VIS Spectroscopy)

ethanol

Comment (UV/VIS Spectroscopy)

250 - 330 nm

Cram; Steinberg; Journal of the American Chemical Society; vol. 76; (1954); p. 2753,2756, View in Reaxys 26 of 30

Description (UV/VIS Spectroscopy)

Spectrum

Solvent (UV/VIS Spectroscopy)

hexane

Wolf; Herold; Zeitschrift fuer Physikalische Chemie, Stoechiometrie und Verwandtschaftslehre; vol. <B> 5; (1929); p. 125, View in Reaxys; Foerster; Skrabal; Wagner; Zeitschrift fuer Elektrochemie und Angewandte Physikalische Chemie; vol. 43; (1937); p. 290, View in Reaxys; Mohler; Lohr; Helvetica Chimica Acta; vol. 20; (1937); p.

1183,1185, View in Reaxys; Benson; Kistiakowsky; Journal of the American Chemical Society; vol. 64; (1942); p.

80,83, 85, View in Reaxys; Ramart-Lucas; Hoch; Bulletin de la Societe Chimique de France; vol. <5> 2; (1935); p.

327,333; Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences; vol. 201; (1935); p. 1387, View in Reaxys 27 of 30

Description (UV/VIS Spectroscopy)

Spectrum

Solvent (UV/VIS Spectroscopy)

ethanol

Wolf; Herold; Zeitschrift fuer Physikalische Chemie, Stoechiometrie und Verwandtschaftslehre; vol. <B> 5; (1929); p. 125, View in Reaxys; Donle; Volkert; Zeitschrift fuer Physikalische Chemie (Leipzig); vol. <B> 8; (1930); p. 60,62, View in Reaxys; Biquard; Bulletin de la Societe Chimique de France; vol. <5> 8; (1941); p. 55,67, View in Reaxys 28 of 30

Description (UV/VIS Spectroscopy)

Spectrum

Solvent (UV/VIS Spectroscopy)

cyclohexane

Biquard; Bulletin de la Societe Chimique de France; vol. <5> 7; (1940); p. 894,902; Bulletin de la Societe Chimique de France; vol. <5> 8; (1941); p. 55,62, 63, View in Reaxys 29 of 30

Description (UV/VIS Spectroscopy)

Spectrum

Solvent (UV/VIS Spectroscopy)

methanol

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Wolf; Herold; Zeitschrift fuer Physikalische Chemie, Stoechiometrie und Verwandtschaftslehre; vol. <B> 5; (1929); p. 125, View in Reaxys; Donle; Volkert; Zeitschrift fuer Physikalische Chemie (Leipzig); vol. <B> 8; (1930); p. 60,62, View in Reaxys 30 of 30

Description (UV/VIS Spectroscopy)

Spectrum

Solvent (UV/VIS Spectroscopy)

heptane

Donle; Volkert; Zeitschrift fuer Physikalische Chemie (Leipzig); vol. <B> 8; (1930); p. 60,62, View in Reaxys ESR Spectroscopy (5) 1 of 5

Description (ESR Spectroscopy)

Spectrum

Temperature (ESR Spectroscopy) [°C]

-196.2

Comment (ESR Spectroscopy)

Solvent(s): further solvent(s)

Tominaga, Keisuke; Yamauchi, Seigo; Hirota, Noboru; Journal of Physical Chemistry; vol. 94; nb. 11; (1990); p.

4425 - 4431, View in Reaxys 2 of 5

Description (ESR Spectroscopy)

Spectrum

Solvents (ESR Spectroscopy)

propan-2-ol

Temperature (ESR Spectroscopy) [°C]

-70 - -10

Yamauchi, Seigo; Hirota, Noboru; Journal of Physical Chemistry; vol. 88; nb. 20; (1984); p. 4631 - 4636, View in Reaxys 3 of 5

Description (ESR Spectroscopy)

CIDEP (chemically induced dynamic electron polarization)

Yamauchi, Seigo; Hirota, Noboru; Journal of Physical Chemistry; vol. 88; nb. 20; (1984); p. 4631 - 4636, View in Reaxys 4 of 5

Description (ESR Spectroscopy)

ESR

Corvaja et al.; Zeitschrift fuer Physikalische Chemie (Muenchen, Germany); vol. 66; (1969); p. 279, View in Reaxys; Tarrasch et al.; Chemical Physics Letters; vol. 48; (1977); p. 579,580-582, View in Reaxys 5 of 5

Description (ESR Spectroscopy)

Spectrum

Sharnoff; Shain; Journal of the American Chemical Society; vol. 95; (1973); p. 6465,6466, View in Reaxys NQR Spectroscopy (1) Description (NQR Nucleus (NQR Spectroscopy) Spectroscopy) Nuclear quadrupole coupling constants

17O

References Delseth, Claude; Kintzinger, Jean-Pierre; Helvetica Chimica Acta; vol. 65; nb. 7; (1982); p. 2273 - 2279, View in Reaxys

Rotational Spectroscopy (4) Description (Rota- Comment (Rota- References tional Spectrosco- tional Spectroscopy) py) Rotational spectrum

Baba, Masaaki; Hanazaki, Ichiro; Journal of Chemical Physics; vol. 81; nb. 12.I; (1984); p. 5426 - 5433, View in Reaxys

Microwave spectrum

Mamleev et al.; Journal of Structural Chemistry; vol. 19; (1978); p. 642; ; p. 744, View in Reaxys; Koekeritz; Selen; Arkiv foer Fysik; vol. 16; (1960); p. 197; Chem.Abstr.; nb. 10517; (1960), View in Reaxys; Shain; Sharnoff; Chemical Physics Letters; vol. 22; (1973); p. 56, View in Reaxys; Kim; Gwinn; Journal of Chemical Physics; vol. 51; (1969); p. 1815,1818, View in Reaxys

Stark effect

Kim; Gwinn; Journal of Chemical Physics; vol. 51; (1969); p. 1815,1818, View in Reaxys

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Microwave spectrum

Mikrowellen-Absorption (17200-24500 MHz).

Raman Spectroscopy (8) Description (Ram- Solvent (Raman an Spectroscopy) Spectroscopy)

Erlandsson; Ark. Fysik; vol. 9; (1955); p. 399,430, View in Reaxys; Burckhalter; Journal of Chemical Physics; vol. 23; (1955); p. 1172, View in Reaxys

Comment (Raman Spectroscopy)

References

Spectrum

neat (no solvent)

temperature dependence

Vaz, Pedro D.; Ribeiro-Claro, Paulo J.A.; Journal of Physical Chemistry A; vol. 107; nb. 32; (2003); p. 6301 - 6305, View in Reaxys

Spectrum

methanol

concentration dependence

Vaz, Pedro D.; Ribeiro-Claro, Paulo J.A.; Journal of Physical Chemistry A; vol. 107; nb. 32; (2003); p. 6301 - 6305, View in Reaxys

Spectrum

CCl4

concentration dependence

Vaz, Pedro D.; Ribeiro-Claro, Paulo J.A.; Journal of Physical Chemistry A; vol. 107; nb. 32; (2003); p. 6301 - 6305, View in Reaxys

Spectrum

Bonino; Manzoni-Ansidei; Mem. Accad. Bologna; vol. <9> 1; (1933); p. 3,6, View in Reaxys; Cherrier; Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences; vol. 225; (1947); p. 930, View in Reaxys; Kohlrausch; Reitz; Stockmair; Zeitschrift fuer Physikalische Chemie (Leipzig); vol. <B> 32; (1936); p. 229,235, View in Reaxys; Reitz; Zeitschrift fuer Physikalische Chemie (Leipzig); vol. <B> 38; (1937); p. 381,386, 389, View in Reaxys; Angell et al.; Spectrochimica Acta; vol. 15; (1959); p. 926,929, View in Reaxys; Lecomte; Gray; Taboury; Bulletin de la Societe Chimique de France; (1947); p. 774,776, 778, View in Reaxys; Biquard; Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences; vol. 204; (1937); p. 1721; Bulletin de la Societe Chimique de France; vol. <5> 7; (1940); p. 894,902, View in Reaxys; Piaux; Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences; vol. 197; (1933); p. 1647, View in Reaxys; Gray; Annales de Chimie (Cachan, France); vol. <12> 3; (1948); p. 355,387, View in Reaxys; Michel; Bulletin des Societes Chimiques Belges; vol. 72; (1963); p. 138, View in Reaxys; Ikeda; Lord; Journal of Chemical Physics; vol. 56; (1972); p. 4450, View in Reaxys; Cataliotti; Paliani; Chemical Physics Letters; vol.

20; (1973); p. 280, View in Reaxys; Batuew et al.; Bulletin of the Academy of Sciences of the USSR, Division of Chemical Science (English Translation); (1961); p. 1050; Izvestiya Akademii Nauk SSSR, Seriya Khimicheskaya; (1961); p. 1138, View in Reaxys

Raman

Fayat; Foucaud; Bulletin de la Societe Chimique de France; (1970); p. 4491,4492-4494, View in Reaxys; Durig et al.; Journal of Molecular Spectroscopy; vol. 27; (1968); p. 285, View in Reaxys; HowardLock; King; Journal of Molecular Spectroscopy; vol. 35; (1970); p.

393, View in Reaxys; Kartha et al.; Canadian Journal of Chemistry; vol. 51; (1973); p. 1749,1754, View in Reaxys; Sablayrolles et al.; Journal de Chimie Physique et de Physico-Chimie Biologique; vol.

66; (1969); p. 1139, View in Reaxys

Bands

(unverd.; 1800-400 cmE-1)

Mecke et al.; Chemische Berichte; vol. 90; (1957); p. 975,977, View in Reaxys

Bands

Struktur der CORaman-Bande

Mangin; Bottreau; Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences; vol. 242; (1956); p. 2637, View in Reaxys

Bands

(unverd.; 3000-200 cmE-1)

Suetaka; Gazzetta Chimica Italiana; vol. 82; (1952); p. 768,770, View in Reaxys

Luminescence Spectroscopy (5) Description (LuReferences minescence Spectroscopy) Thermoluminescence

Veen, Reinout H, Van Der; Cerfontain, Hans; Tetrahedron; vol. 41; nb. 3; (1985); p. 585 - 594, View in Reaxys

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Luminescence quantum yield

Shortridge jr. et al.; Journal of the American Chemical Society; vol. 93; (1971); p. 1863, View in Reaxys; Yang et al.; Journal of the Chemical Society, Chemical Communications; (1976); p. 727, View in Reaxys; Kellogg; Journal of the American Chemical Society; vol. 91; (1969); p. 5433, View in Reaxys; Hamer; Huber; Chemical Physics Letters; vol. 55; (1978); p. 543,545, View in Reaxys; O'Sullivan; Testa; Journal of Luminescence; vol. 10; (1975); p. 123, View in Reaxys

Luminescence lifetime

Turro et al.; Journal of the American Chemical Society; vol. 93; (1971); p. 7213,7221, View in Reaxys; Wagner; Spoerke; Journal of the American Chemical Society; vol. 91; (1969); p. 4437, View in Reaxys; Yang et al.; Journal of the Chemical Society, Chemical Communications; (1976); p. 727, View in Reaxys; Hamer; Huber; Chemical Physics Letters; vol. 55; (1978); p. 543,545, View in Reaxys; Loutfy; Somersall; Canadian Journal of Chemistry; vol. 54; (1976); p. 760,761, View in Reaxys; Sharnoff; Shain; Journal of the American Chemical Society; vol. 95; (1973); p. 6465,6466, View in Reaxys; Dalton; Snyder; Journal of the American Chemical Society; vol. 97; (1975); p. 5192,5193 - 5194, View in Reaxys

Luminescence quenching

Dalton; Snyder; Journal of the American Chemical Society; vol. 97; (1975); p. 5192,5193 - 5194, View in Reaxys

Luminescence

Dubois, Cox; Journal of Chemical Physics; vol. 38; (1963); p. 2536, View in Reaxys; Grokom; Glick; International Journal of Mass Spectrometry and Ion Physics; vol. 4; (1970); p. 203, View in Reaxys

Fluorescence Spectroscopy (3) Description (Fluo- Comment (Fluorescence Specrescence Spectroscopy) troscopy)

References

Spectrum

excited singlet state

Laane, Jaan; Journal of Physical Chemistry A; vol. 104; nb. 33; (2000); p. 7715 - 7733, View in Reaxys

Maxima

405 nm

Veen, Reinout H, Van Der; Cerfontain, Hans; Tetrahedron; vol. 41; nb. 3; (1985); p.

585 - 594, View in Reaxys

Fluorescence

Dubois, Cox; Journal of Chemical Physics; vol. 38; (1963); p. 2536, View in Reaxys; Breuer; Lee; Journal of Physical Chemistry; vol. 75; (1971); p. 989, View in Reaxys; O'Sullivan; Testa; Journal of Physical Chemistry; vol. 77; (1973); p. 1830, View in Reaxys; Shortridge jr. et al.; Journal of the American Chemical Society; vol. 93; (1971); p. 1863, View in Reaxys; Breuer; Lee; Chemical Physics Letters; vol. 14; (1972); p. 404, View in Reaxys; Hamer; Huber; Chemical Physics Letters; vol. 55; (1978); p.

543,545, View in Reaxys; Paglia; Roquille; Journal of Physical Chemistry; vol. 66; (1962); p. 1739, View in Reaxys; Paglia; Roquitte; Canadian Journal of Chemistry; vol.

41; (1963); p. 287, View in Reaxys

Phosphorescence Spectroscopy (2) Description Solvent (PhosComment (Phos(Phosphoresphorescence phorescence cence SpectroSpectroscopy) Spectroscopy) scopy) Spectrum

neat (no solvent)

625 - 384.62 nm

Phosphorescence

References

Shcheglova, N. A.; Shigorin, D. N.; Lesnenko, L. G.; Russian Journal of Physical Chemistry; vol. 55; nb. 1; (1981); p. 69 - 72; Zhurnal Fizicheskoi Khimii; vol. 55; nb. 1; (1981); p. 133 - 137, View in Reaxys Yang et al.; Journal of the Chemical Society, Chemical Communications; (1976); p. 727, View in Reaxys; Hamer; Huber; Chemical Physics Letters; vol. 55; (1978); p. 543,545, View in Reaxys; Baba; Hirota; Chemical Physics Letters; vol. 64; (1979); p. 321, View in Reaxys; Tarrasch et al.; Chemical Physics Letters; vol. 48; (1977); p. 579,580-582, View in Reaxys; Sharnoff; Shain; Journal of the American Chemical Society; vol. 95; (1973); p. 6465,6466, View in Reaxys; O'Sullivan; Testa; Journal of Luminescence; vol.

10; (1976); p. 123,126, View in Reaxys; O'Sullivan; Testa; Journal of Luminescence; vol. 10; (1975); p. 123, View in Reaxys; Power; Nishimura; Journal of Photochemistry; vol. 8; (1978); p. 263,264, View in Reaxys; Shain; Sharnoff; Chemical Physics Letters; vol. 22; (1973); p. 56, View in Reaxys; Paglia; Roquille; Journal of Physical Chemistry; vol. 66; (1962); p. 1739, View in Reaxys

Other Spectroscopic Methods (1) Description (Oth- References er Spectroscopic Methods) Photoelectron spectrum

Hentrich et al.; Journal of Molecular Structure; vol. 21; (1974); p. 231,239, View in Reaxys; Chadwick et al.; Journal of the American Chemical Society; vol. 93; (1971); p. 4320, View in Reaxys; Kovac; Klasinc; Croatica Chemica Acta; vol. 51; (1978); p. 55,62, 66, View in Reaxys; Zimmermann et al.; Journal of the American

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Chemical Society; vol. 100; (1978); p. 4674, View in Reaxys; Chadwick et al.; Tetrahedron Letters; (1971); p. 4543, View in Reaxys; Sandorfy, Camille; Lewis, Jerry W.; Wladislaw, Blanka; Calegao, Isabel C. C.; Phosphorus and Sulfur and the Related Elements; vol. 16; (1983); p. 287 - 292, View in Reaxys; Cornish, Timothy J.; Baer, Tomas; Journal of the American Chemical Society; vol. 109; nb. 23; (1987); p. 6915 6920, View in Reaxys; Cornish, Timothy J.; Baer, Tomas; Journal of the American Chemical Society; vol.

110; nb. 19; (1988); p. 6287 - 6291, View in Reaxys Exposure Assessment (2) Exposure Sources

References

presence in emis- heating of nitrosions gen-containing plastics such as polyamide 6 at low temp. (<=300 deg C); table indoor pollution from textile floor coverings

Watanabe, Mafumi; Nakata, Chisto; Wu, Wei; Kawamoto, Katsuya; Noma, Yukio; Chemosphere; vol. 68; nb. 11; (2007); p. 2063 - 2072, View in Reaxys

carpets; concen- Sollinger, S.; Levsen, K.; Wuensch, G.; Atmospheric Environment; vol. 28; nb. 14; tration on textile (1994); p. 2369 - 2378, View in Reaxys floor covering with polyamide pile and styrene-butadiene rubber backing; most common type in Europe; probably from impurities of monomers, additives used to accelerate vulcanization or to reduce rubber ageing

Concentration in the Environment (1) 1 of 1

Media (Concentration in the Environment)

air

Contamination Concentration

9.09 ng/l

Method, Remarks (Concentration in the Environment)

average conc.; gas phase samples collected after combustion of standard smoke incense made of dried vegetation Santalum album L.; GC with MSD analysis; US EPA TO-14A method (US EPA, 1997); table

Yang; Lin; Chang; Bulletin of Environmental Contamination and Toxicology; vol. 78; nb. 5; (2007); p. 308 - 313, View in Reaxys Transport and Distribution (4) 1 of 4

Type (Transport and Distribution)

partition

Media (Transport and Distribution)

air - Leonardite humic acid

Results

Leonardite humic acid/air partition coefficient, KHA,air = 1.23E4 - 2.67E4 l/kgHA; relative humidity affected experimental partition coefficient by up to a factor of 3

Method, Remarks (Transport and Distribution)

dynamic flow-through technique; IGC-FID; title comp. injected onto the column packed with humic acid (<2 μm thick) coated glass beads; equilibrated at least 48 h; <0.01 percent-98 percent relative humidity; 15 deg C; relative humidity effect on partition equilibrium

Niederer, Christian; Goss, Kai-Uwe; Schwarzenbach, Rene P.; Environmental Science and Technology; vol. 40; nb. 17; (2006); p. 5368 - 5373, View in Reaxys 2 of 4

Type (Transport and Distribution)

sorption

Media (Transport and Distribution)

air - Leonardite humic acid

Results

experimental sorption enthalpy, ΔabsHi = -48.2 kJ/mol

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Method, Remarks (Transport and Distribution)

dynamic flow-through technique; IGC-FID; title comp. injected onto the column packed with humic acid (<2 μm thick) coated glass beads; equilibrated for 80 d; 98 percent relative humidity; 5 to 75 deg C

Niederer, Christian; Goss, Kai-Uwe; Schwarzenbach, Rene P.; Environmental Science and Technology; vol. 40; nb. 17; (2006); p. 5368 - 5373, View in Reaxys 3 of 4

Type (Transport and Distribution)

partition

Media (Transport and Distribution)

air - Leonardite humic acid

Results

Leonardite humic acid/air partition coefficient, KHA,air = 1.91E3 - 2.30E4 l/kgHA; no glass transitions below 75 deg C that had an effect on the sorption properties of humic acid as indicated by linear van't Hoff plot

Method, Remarks (Transport and Distribution)

dynamic flow-through technique; IGC-FID; title comp. injected onto the column packed with humic acid (<2 μm thick) coated glass beads; equilibrated for 80 d; 98 percent relative humidity; 5-75 deg C; temperature dependence of partition equilibrium studied

Niederer, Christian; Goss, Kai-Uwe; Schwarzenbach, Rene P.; Environmental Science and Technology; vol. 40; nb. 17; (2006); p. 5368 - 5373, View in Reaxys 4 of 4

Type (Transport and Distribution)

sorption

Media (Transport and Distribution)

air - snow

Results

log Ki snow surface/air (m3/m2): -2.81; Ki snow surface/air: air/snow surface sorption coefficient

Method, Remarks (Transport and Distribution)

snow from Central Swiss Alp collected on January 10, 2003; 46 deg 37' 02" N, 8 deg 35' 38" E; altitude: ca. 2278 m above sea level; sorption coefficient determined from retention volume; -6.8 deg C; inverse gas chromatography analysis

Roth, Christine M.; Goss, Kai-Uwe; Schwarzenbach, Rene P.; Environmental Science and Technology; vol. 38; nb. 15; (2004); p. 4078 - 4084, View in Reaxys Use (13) Use Pattern

Location

References

Page/Page column 10

Patent; PHARMAXYN LABORATORIES LTD.; AO, GUIZHEN; NIE, JIHUA; LI, HUANQIU; MO, LINGXUAN; CHEN, LEI; SONG, HENG; CHEN, SHAOHUA; US2015/259271; (2015); (A1) English, View in Reaxys

cyclic ketone in Page/Page colmethod for preumn 10 paring the compound of α-(3,5dimethoxybenzylidene)-α'-hydrocarbyl methylene cyclic ketone

Patent; PHARMAXYN LABORATORIES LTD.; AO, GUIZHEN; NIE, JIHUA; LI, HUANQIU; MO, LINGXUAN; CHEN, LEI; SONG, HENG; CHEN, SHAOHUA; US2015/259271; (2015); (A1) English, View in Reaxys

Agricultural use

Page/Page column 108; 110

Patent; OLFACTOR LABORATORIES INCORPORATED; BROWN, Michelle, Ardella; LOMELI, Martin, Antonio, Jr.; ELKASHEF, Samer; ZION, Tricia; FRUTOS, Ulises; WO2014/28835; (2014); (A2) English, View in Reaxys

killing a vector pest toward a flying dipteran, bad bugs

Page/Page column 108; 110

Patent; OLFACTOR LABORATORIES INCORPORATED; BROWN, Michelle, Ardella; LOMELI, Martin, Antonio, Jr.; ELKASHEF, Samer; ZION, Tricia; FRUTOS, Ulises; WO2014/28835; (2014); (A2) English, View in Reaxys

repelling a vector pest

Page/Page column 108; 110

Patent; OLFACTOR LABORATORIES INCORPORATED; BROWN, Michelle, Ardella; LOMELI, Martin, Antonio, Jr.; ELKASHEF, Samer; ZION, Tricia; FRUTOS, Ulises; WO2014/28835; (2014); (A2) English, View in Reaxys

Chemical processes/laboratory use

preparation of ketone/aldehyde resins for nail varnish

Patent; Coffey-Dawe, Lizabeth-Anne; Guerchet, Laurence; US2008/145325; (2008); (A1) English, View in Reaxys

Solvent for pesticide formulations

Patent; PBI/GORDON CORPORATION; US2008/90780; (2008); (A1) English, View in Reaxys

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Component of organic extraction solution in process for converting sugars to furan derivatives

Patent; WISCONSIN ALUMNI RESEARCH FOUNDATION; WO2007/146636; (2007); (A1) English, View in Reaxys

Solvent

Patent; LUPIN LTD.; WO2005/95374; (2005); (A1) English, View in Reaxys; Patent; Panov, Gennady Ivanovich; Dubkov, Konstantin Alexandrovich; Starokon, Evgeny Vladimirovich; Pirutko, Larisa Vladimirovna; US2006/106258; (2006); (A1) English, View in Reaxys; Patent; DAICEL CHEMICAL INDUSTRIES, LTD.; EP1681284; (2006); (A1) English, View in Reaxys

Synthesis of δ-valerolactone

Patent; Panov, Gennady Ivanovich; Dubkov, Konstantin Alexandrovich; Starokon, Evgeny Vladimirovich; Pirutko, Larisa Vladimirovna; US2006/106258; (2006); (A1) English, View in Reaxys

Synthesis of glutaric acid

Patent; Panov, Gennady Ivanovich; Dubkov, Konstantin Alexandrovich; Starokon, Evgeny Vladimirovich; Pirutko, Larisa Vladimirovna; US2006/106258; (2006); (A1) English, View in Reaxys

Synthesis of sebacic acid

Patent; Panov, Gennady Ivanovich; Dubkov, Konstantin Alexandrovich; Starokon, Evgeny Vladimirovich; Pirutko, Larisa Vladimirovna; US2006/106258; (2006); (A1) English, View in Reaxys

preparation of 4hydroxy-pyran-2one derivatives

Patent; LUPIN LTD.; WO2005/95374; (2005); (A1) English, View in Reaxys

Isolation from Natural Product (8) Isolation from References Natural Product gek. Schweineleber, Wasserdampfdestillation

Mussinan; Walradt; Journal of Agricultural and Food Chemistry; vol. 22; (1974); p. 827,830, View in Reaxys

aus Kaffeearoma

Stoll et al.; Helvetica Chimica Acta; vol. 50; (1967); p. 628,635, View in Reaxys

Abtrennung aus Gemischen mit Cyclopentanol

Patent; Phillips Petr. Co.; US2623072; (1946), View in Reaxys

Isolierung aus einem bei der Vergaerung von Holzzucker erhaltenen Fuseloel

Enders; Kaernbach; Holz; vol. 2; (1939); p. 135,137, View in Reaxys

Isolierung aus Holzgeist-Oel

Rybin; Medwedew; Zhurnal Prikladnoi Khimii (Sankt-Peterburg, Russian Federation); vol. 6; (1933); p.

311,318; Chem. Zentralbl.; vol. 105; nb. I; (1934); p. 1572, View in Reaxys

Isolierung aus BraunkohlenTeeroel

Herzenberg; v. Winterfeld; Chemische Berichte; vol. 64; (1931); p. 1025,1033, View in Reaxys

im Holzgeistoel

Pringsheim; Leibowitz; Chemische Berichte; vol. 56; (1923); p. 2040, View in Reaxys; Pringsheim; Schreiber; Cellulosech.; vol. 8; p. 46,54; Chem. Zentralbl.; vol. 98; nb. II; (1927); p. 1224, View in Reaxys

bei der trocknen Destillation der Braunkohle

Vorlaender; Goernandt; Angewandte Chemie; vol. 39; (1926); p. 1117, View in Reaxys

Medchem (42) 1 of 42

Target Mutant/Chimera Details

enzyme:Wild

Target Subunit Proteins

enzyme

Target Transfection

Non Transfected

Bioassay Category

In Vitro (Efficacy)

Bioassay Name

In Vitro (others)

Bioassay Details

Effect : |enzyme; examination of Bioassay : one unit of enzyme act. defined as enzyme catalyzing 1 μmol of NADH formation in ketone reduction; specific act. - enzyme act./mg

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of protein test sp. from cytosolic fr. of Gluconobacter frateurii CHM 9; enzyme act. measured by recording rate decrease of NADH at 340 nm at 25 deg C, pH 6.0 Substance RN

605573View in Reaxys

Substance Name

1430873

Qualitative Results

enzyme catalyzed reduction of title comp. to cyclopentanol

Measurement Parameter

Qualitative

Target, Subunit, Species enzyme

2 of 42

Target Subunit Synonyms

catalytic; enzyme

Target Mutant/Chimera Details

enzyme:Wild

Target Subunit Proteins

enzyme

Target Transfection

Non Transfected

Bioassay Category

In Vitro (Efficacy)

Bioassay Name

In Vitro (others)

Bioassay Details

Effect : |enzyme; examination of Bioassay : one unit of enzyme act. defined as enzyme catalyzing 1 μmol of substrate reduction per min; specific act. defined as enzyme act./mg of protein test sp. from Gluconobacter frateurii CHM 9; enzyme used as purified from membrane and containing in membrane fraction of organism; enzyme act. measured with potassium ferricyanide or phenazine methosulfate + 2,6-dichlorophenol indophenol at pH 5.0

Substance RN

605573View in Reaxys

Substance Name

1430873

Qualitative Results

enzyme not catalyzed reduction of title comp.

Measurement Parameter

Qualitative

Target, Subunit, Species enzyme

3 of 42

Target Subunit Synonyms

catalytic; enzyme

Bioassay Category

In Vitro (Efficacy)

Bioassay Name

In Vitro (others)

Substance RN

605573View in Reaxys

Substance Name

1430873

Qualitative Results

binding affinity to 8-CN flavin mononucleotide old yellow enzyme (8-CN-FMN-OYE) in air saturated solution: Km=8.4E-4 M

Measurement Parameter

Qualitative

Murthy, Yerramilli V. S. N.; Meah, Younus; Massey, Vincent; Journal of the American Chemical Society; vol. 121; nb. 22; (1999); p. 5344 - 5345, View in Reaxys 4 of 42

Bioassay Category

In Vitro (Efficacy)

Bioassay Name

In Vitro (others)

Bioassay Details

Effect : HSF transcription factor, activation ofTarget : T lymphoid human cells (Jurkat cell line) of humanBioassay : treating with compound at 125-100 uM for 1 hour; stimulation with 12-o-tetradecanoyl-phorbol-13-acetate (TPA) (25 ng/ml). preparation of whole-cell extracts after 3 hours; subjection to EMSA

Substance RN

605573View in Reaxys

Substance Name

1430873

Measurement Parameter

Qualitative

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Qualitative value

NA

Patent; Consiglio Nazionale Delle Richerche; US6392100; (2002); (B1) English, View in Reaxys 5 of 42

Substance Effect

Reproductive Effect

Bioassay Category

In Vitro (Efficacy)

Bioassay Name

In Vitro (others)

Bioassay Details

Effect : germinationTarget : Nicotiana attenuata Torr. ex. Watson, SolanaceaeBioassay : 14 light : 10 dark photoperiod with 200 μM/m2/sec PAR; 30 deg C day - 22 deg C night temp. cycle; 9.8 mM aq. KNO3 seeds

Substance RN

605573View in Reaxys

Substance Name

1430873

Qualitative Results

no stimulation of germination in compared with extract of wood smoke

Measurement Parameter

Qualitative

Baldwin; Staszak-Kozinski; Davidson; Journal of Chemical Ecology; vol. 20; nb. 9; (1994); p. 2345 - 2371, View in Reaxys 6 of 42

Substance Effect

Cytotoxic

Bioassay Category

In Vitro (Efficacy)

Bioassay Name

In Vitro (others)

Bioassay Details

Target : FHM (fathead minnow fish) cellsBioassay : NI50 - conc. of test compound required to induce a 50 percent reduction in neutral red uptake FHM cells: Americal Type Culture Collection N CC142; chemical emulsified with complete culture medium (10 percent fetal calf serum) using Sonifier 450 ultrasonicator for 1 min; 60000 FHM cells used; cultures treated for 2 h with different conc. of chemical

Substance RN

605573View in Reaxys

Substance Name

1430873

Qualitative Results

NI50 correlate with fish lethality data; valuable for fish lethality testing 16151 mg/l

Measurement Parameter

Qualitative

Solari, Paola; Dierickx, Paul J.; Chemosphere; vol. 28; nb. 8; (1994); p. 1495 - 1501, View in Reaxys 7 of 42

Target Mutant/Chimera Details

enzyme:Wild

Target Subunit Proteins

enzyme

Target Transfection

Non Transfected

Bioassay Category

In Vitro (Efficacy)

Bioassay Name

In Vitro (others)

Bioassay Details

Effect : |enzyme; examination of Bioassay : in vitro; carbonyl reductase activity determined spectrophotometrically by measuring oxidation rate of NADPH; 80 mM NADPH; potassium phosphate buffer, pH 6.5; 37 deg C

Substance RN

605573View in Reaxys

Substance Name

1430873

Substance Dose

0.300000 µM

Qualitative Results

exhibited carbonyl reductase activity with Km of 4.34 mM and Vmax of 101 nmol/min/mg (Vmax/Km: 23.3)

Measurement Parameter

Qualitative

Target, Subunit, Species enzyme Nakajin, Shizuo; Tamura, Fumihiro; Takase, Noriko; Toyoshima, Satoshi; Biological and Pharmaceutical Bulletin; vol. 20; nb. 11; (1997); p. 1215 - 1218, View in Reaxys

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8 of 42

Target Subunit Synonyms

catalytic; enzyme

Bioassay Category

In Vitro (Efficacy)

Bioassay Name

In Vitro (others)

Substance RN

605573View in Reaxys

Substance Name

1430873

Qualitative Results

no inhibition of the growth of Nocardia sp. strain KUC-7N at a concentration of 0.2percent

Measurement Parameter

Qualitative

Hasegawa, Yoshie; Hamano, Katsuhiko; Obata, Hitoshi; Tokuyama, Tai; Agricultural and Biological Chemistry; vol. 46; nb. 5; (1982); p. 1139 - 1144, View in Reaxys 9 of 42

Bioassay Category

In Vitro (Efficacy)

Bioassay Name

In Vitro (others)

Bioassay Details

Bioassay : snow from Central Swiss Alp collected on January 10, 2003; 46 deg 37' 02" N, 8 deg 35' 38" E; altitude: ca. 2278 m above sea level; sorption coefficient determined from retention volume; -6.8 deg C; inverse gas chromatography analysis

Substance RN

605573View in Reaxys

Substance Name

1430873

Qualitative Results

sorption log Ki snow surface/air (m3/m2): -2.81; Ki snow surface/air: air/snow surface sorption coefficient

Measurement Parameter

Qualitative

Roth, Christine M.; Goss, Kai-Uwe; Schwarzenbach, Rene P.; Environmental Science and Technology; vol. 38; nb. 15; (2004); p. 4078 - 4084, View in Reaxys 10 of 42

Bioassay Category

In Vitro (Efficacy)

Bioassay Name

In Vitro (others)

Bioassay Details

Bioassay : dynamic flow-through technique; IGC-FID; title comp. injected onto the column packed with humic acid (<2 μm thick) coated glass beads; equilibrated at least 48 h; <0.01 percent-98 percent relative humidity; 15 deg C; relative humidity effect on partition equilibrium

Substance RN

605573View in Reaxys

Substance Name

1430873

Qualitative Results

partition Leonardite humic acid/air partition coefficient, KHA,air = 1.23E4 - 2.67E4 l/kgHA; relative humidity affected experimental partition coefficient by up to a factor of 3

Measurement Parameter

Qualitative

Niederer, Christian; Goss, Kai-Uwe; Schwarzenbach, Rene P.; Environmental Science and Technology; vol. 40; nb. 17; (2006); p. 5368 - 5373, View in Reaxys 11 of 42

Bioassay Category

In Vitro (Efficacy)

Bioassay Name

In Vitro (others)

Bioassay Details

Bioassay : dynamic flow-through technique; IGC-FID; title comp. injected onto the column packed with humic acid (<2 μm thick) coated glass beads; equilibrated for 80 d; 98 percent relative humidity; 5 to 75 deg C

Substance RN

605573View in Reaxys

Substance Name

1430873

Qualitative Results

sorption experimental sorption enthalpy, ΔabsHi = -48.2 kJ/mol

Measurement Parameter

Qualitative

Niederer, Christian; Goss, Kai-Uwe; Schwarzenbach, Rene P.; Environmental Science and Technology; vol. 40; nb. 17; (2006); p. 5368 - 5373, View in Reaxys

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12 of 42

Bioassay Category

In Vitro (Efficacy)

Bioassay Name

In Vitro (others)

Bioassay Details

Bioassay : dynamic flow-through technique; IGC-FID; title comp. injected onto the column packed with humic acid (<2 μm thick) coated glass beads; equilibrated for 80 d; 98 percent relative humidity; 5-75 deg C; temperature dependence of partition equilibrium studied

Substance RN

605573View in Reaxys

Substance Name

1430873

Qualitative Results

partition Leonardite humic acid/air partition coefficient, KHA,air = 1.91E3 - 2.30E4 l/kgHA; no glass transitions below 75 deg C that had an effect on the sorption properties of humic acid as indicated by linear van't Hoff plot

Measurement Parameter

Qualitative

Niederer, Christian; Goss, Kai-Uwe; Schwarzenbach, Rene P.; Environmental Science and Technology; vol. 40; nb. 17; (2006); p. 5368 - 5373, View in Reaxys 13 of 42

Target Mutant/Chimera Details

Cytochrome P450 2A6 [human]:Wild

Target Species (Bioactivity)

human

Target Subunit Proteins

Cytochrome P450 2A6 [human]

Bioassay Category

Metabolism/Transport

Bioassay Details

In vitro logarithmic inhibitory concentration of the compound (dissolved in DMSO ) against human liver microsomes CYTOCHROME P450 2A6 expressed in BACULOVIRUS-INSECT CELLS upon incubation using 10 uM COUMARIN, 0.3 mM NADPH in 50 mM TRISHCl buffer, pH 7.4 at 37 degree C for 10 min

Biological Species/NCBI Human ID Substance RN

605573View in Reaxys

Qualitative Results

Activity value taken from supplementary data

Measurement Parameter

pIC50

Quantitative value

0.46

Target, Subunit, Species Cytochrome P450 2A6 [human]

14 of 42

Target Subunit Synonyms

1,4-cineole 2-exo-monooxygenase (cytochrome p450 2a6); coumarin 7-hydroxylase; cyp2a3; cyp2a6; cypiia6; cytochrome p450 2a6; cytochrome p450 iia3; cytochrome p450(i)

Target Uniprot ID

p11509

Target PDB ID

1z10; 1z11; 2fdu; 2fdv; 2fdw; 2fdy; 3ebs; 3t3q; 3t3r; 4ejj; 4rui

Compound name

COUMARIN; NADPH

Compound role

SUB; COM

Bioassay Category

In Vivo (Animal models)

Bioassay Details

Percent control of serum cholesterol in rat at p.o. dose of 10 mg/kg on day 4

Biological Species/NCBI Rattus norvegicus ID Substance RN

605573View in Reaxys

Substance Route of Adm.

oral administration

Measurement Parameter

%

Unit

%

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Qualitative value

=

Quantitative value

92

Deviation

18

Piantadosi; Hall; Irvine; Carlson; Journal of Medicinal Chemistry; vol. 16; nb. 7; (1973); p. 770 - 775, View in Reaxys

15 of 42

Measurement Object

Serum cholesterol levels

Bioassay Category

In Vivo (Animal models)

Bioassay Details

Percent control of serum cholesterol in rat at p.o. dose of 10 mg/kg on day 10

Biological Species/NCBI Rattus norvegicus ID Substance RN

605573View in Reaxys

Substance Route of Adm.

oral administration

Measurement Parameter

%

Unit

%

Qualitative value

=

Quantitative value

92

Deviation

5

Piantadosi; Hall; Irvine; Carlson; Journal of Medicinal Chemistry; vol. 16; nb. 7; (1973); p. 770 - 775, View in Reaxys

16 of 42

Measurement Object

Serum cholesterol levels

Bioassay Category

Metabolism/Transport

Bioassay Details

Percent reabsorption in female CF1 mice was evaluated

Biological Species/NCBI Mus musculus ID Substance RN

605573View in Reaxys

Measurement Parameter

Activity

Unit

%

Qualitative value

=

Quantitative value

345

Hall; Carlson; Abernethy; Piantadosi; Journal of Medicinal Chemistry; vol. 17; nb. 12; (1974); p. 1253 - 1257, View in Reaxys 17 of 42

Bioassay Category

In Vivo (Animal models)

Bioassay Details

Percent control of serum cholesterol in rat at p.o. dose of 10 mg/kg on day 16

Biological Species/NCBI Rattus norvegicus ID Substance RN

605573View in Reaxys

Substance Route of Adm.

oral administration

Measurement Parameter

%

Unit

%

Qualitative value

=

Quantitative value

83

Deviation

11

Copyright © 2017 Reed Elsevier Properties SA. All rights reserved. Authorized use only. Reaxys® and the Reaxys® trademark are owned and protected by Reed Elsevier Properties SA and used under license.

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Piantadosi; Hall; Irvine; Carlson; Journal of Medicinal Chemistry; vol. 16; nb. 7; (1973); p. 770 - 775, View in Reaxys

18 of 42

Measurement Object

Serum cholesterol levels

Bioassay Category

In Vitro (Efficacy)

Bioassay Details

Percent viable fetus in female CF1 mice was evaluated

Biological Species/NCBI Mus musculus ID Substance RN

605573View in Reaxys

Measurement Parameter

%

Unit

%

Qualitative value

=

Quantitative value

76

Hall; Carlson; Abernethy; Piantadosi; Journal of Medicinal Chemistry; vol. 17; nb. 12; (1974); p. 1253 - 1257, View in Reaxys

19 of 42

Measurement Object

Viability rate

Bioassay Category

In Vitro (Efficacy)

Bioassay Details

Percent pregnancy in female CF1 mice was evaluated

Biological Species/NCBI Mus musculus ID Substance RN

605573View in Reaxys

Measurement Parameter

%

Unit

%

Qualitative value

=

Quantitative value

88

Hall; Carlson; Abernethy; Piantadosi; Journal of Medicinal Chemistry; vol. 17; nb. 12; (1974); p. 1253 - 1257, View in Reaxys

20 of 42

Measurement Object

Pregnancy index

Bioassay Category

In Vitro (Efficacy)

Bioassay Details

Percent increase of rat body weight was measured on day 16 upon administration of the compound

Biological Species/NCBI Rattus norvegicus ID Substance RN

605573View in Reaxys

Measurement Parameter

% Stimulation

Unit

%

Qualitative value

=

Quantitative value

151

Deviation

2

Piantadosi; Hall; Irvine; Carlson; Journal of Medicinal Chemistry; vol. 16; nb. 7; (1973); p. 770 - 775, View in Reaxys

21 of 42

Measurement Object

Increase rate

Target Mutant/Chimera Details

Phenylethanolamine N-methyltransferase [taurine cattle]:Wild

Substance Action on Target

Inhibitor

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Target Species (Bioactivity)

taurine cattle

Target Subunit Proteins

Phenylethanolamine N-methyltransferase [taurine cattle]

Bioassay Category

In Vitro (Efficacy)

Bioassay Details

Inhibitory concentration of the compound against bovine adrenal medulla phenylethanolamine N-methyltransferase upon incubation in phosphate buffer (25 uM), pH 8.0 at 37 degree C for 10 minutes

Biological Species/NCBI taurine cattle ID Substance RN

605573View in Reaxys

Measurement Parameter

IC50

Unit

µM

Qualitative value

>

Quantitative value

1000

Measurement pX

1

Target, Subunit, Species Phenylethanolamine N-methyltransferase [taurine cattle]

22 of 42

Target Subunit Synonyms

noradrenaline n-methyltransferase; phenylethanolamine n-methyltransferase; pnmt; pnmtase

Target Uniprot ID

p10938

Bioassay Category

Toxicity/Safety Pharmacology

Bioassay Details

Toxicity of compound was determined in golden orfe fish (Leuciscus idus melanotus)

Biological Species/NCBI Leuciscus ID Substance RN

605573View in Reaxys

Unit

µM

Qualitative value

=

Quantitative value

1.359

Wilson; Famini; Journal of Medicinal Chemistry; vol. 34; nb. 5; (1991); p. 1668 - 1674, View in Reaxys

23 of 42

Measurement Object

Toxicity

Bioassay Category

In Vitro (Efficacy)

Bioassay Details

Anticonvulsant activity of the compound; A denotes that the compound is anticonvulsant

Substance RN

605573View in Reaxys

Qualitative Results

A

Measurement Parameter

Activity

Qualitative value

ND

Bruno-Blanch; Galvez; Garcia-Domenech; Bioorganic and Medicinal Chemistry Letters; vol. 13; nb. 16; (2003); p.

2749 - 2754, View in Reaxys

24 of 42

Measurement Object

Anticonvulsant activity

Target Mutant/Chimera Details

cpA [Aedes aegypti]:Wild

Target Species (Bioactivity)

Aedes aegypti

Target Subunit Proteins

cpA [Aedes aegypti]

Target Transfection

Non Transfected

Bioassay Category

In Vivo (Animal models)

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Biological Species/NCBI Aedes aegypti ID Substance RN

605573View in Reaxys

Measurement Parameter

activation spikes

Unit

s-1

Quantitative value

120.1

Target, Subunit, Species cpA [Aedes aegypti]

25 of 42

Target Subunit Synonyms

cpa

Measurement Object

of cPA receptor

Target Mutant/Chimera Details

cpA [Culex quinquefasciatus]:Wild

Target Species (Bioactivity)

Culex quinquefasciatus

Target Subunit Proteins

cpA [Culex quinquefasciatus]

Target Transfection

Non Transfected

Bioassay Category

In Vivo (Animal models)

Biological Species/NCBI Culex quinquefasciatus ID Substance RN

605573View in Reaxys

Measurement Parameter

% increase

Qualitative value

Active

Target, Subunit, Species cpA [Culex quinquefasciatus]

26 of 42

Target Subunit Synonyms

cpa

Measurement Object

of number of mosquitoes attracted

Target Mutant/Chimera Details

cpA [Aedes aegypti]:Wild

Target Species (Bioactivity)

Aedes aegypti

Target Subunit Proteins

cpA [Aedes aegypti]

Target Transfection

Non Transfected

Bioassay Category

In Vivo (Animal models)

Biological Species/NCBI Aedes aegypti ID Substance RN

605573View in Reaxys

Measurement Parameter

% increase

Qualitative value

Active

Target, Subunit, Species cpA [Aedes aegypti]

27 of 42

Target Subunit Synonyms

cpa

Measurement Object

of number of mosquitoes attracted

Bioassay Category

In Vitro (Efficacy)

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Bioassay Details

Percent relative reduction of compound (1 mM, dissolved in dimethyl sulfoxide) by Escherichia coli HB 101 (pNTOM3) in presence of NADPH (0.25 mM) upon incubation in 100 mM phosphate buffer, pH 6.5 for 1 min at 30 degree C when compared to control (CBPB)=100

Biological Species/NCBI Escherichia coli HB101 ID Substance RN

605573View in Reaxys

Measurement Parameter

Activity

Unit

%

Qualitative value

=

Quantitative value

8

Patent; Kaneka Corporation; US7794993; (2010); (B2) English, View in Reaxys

28 of 42

Measurement Object

relative activity

Target Mutant/Chimera Details

carbonyl reductase (NADPH):Wild

Target Subunit Proteins

carbonyl reductase (NADPH)

Bioassay Category

In Vitro (Efficacy)

Bioassay Details

Activity of the compound against Carbonyl reductase

Substance RN

605573View in Reaxys

Qualitative Results

Not Published

Measurement Parameter

Qualitative

Qualitative value

Not Published

Target, Subunit, Species carbonyl reductase (NADPH) Patent; Kaneka Corporation; US7794993; (2010); (B2) English, View in Reaxys

29 of 42

Target Subunit Synonyms

carbonyl reductase; carbonyl reductase (nadph); nadph-dependent carbonyl reductase; nadph2-dependent carbonyl reductase; nonspecific nadph-dependent carbonyl reductase; secondary-alcohol:nadp+ oxidoreductase

Bioassay Category

In Vitro (Efficacy)

Bioassay Details

Percent relative reduction of compound (1 mM, dissolved in dimethyl sulfoxide) by Escherichia coli HB 101 (pNTOM4) in presence of NADPH (0.25 mM) upon incubation in 100 mM phosphate buffer, pH 6.5 for 1 min at 30 degree C when compared to control (CBPB)=100

Biological Species/NCBI Escherichia coli HB101 ID Substance RN

605573View in Reaxys

Measurement Parameter

Activity

Unit

%

Qualitative value

=

Quantitative value

0

Patent; Kaneka Corporation; US7794993; (2010); (B2) English, View in Reaxys

30 of 42

Measurement Object

relative activity

Target Mutant/Chimera Details

carbonyl reductase (NADPH):Wild

Target Subunit Proteins

carbonyl reductase (NADPH)

Bioassay Category

In Vitro (Efficacy)

Bioassay Details

Activity of the compound against Carbonyl reductase

Substance RN

605573View in Reaxys

Copyright © 2017 Reed Elsevier Properties SA. All rights reserved. Authorized use only. Reaxys® and the Reaxys® trademark are owned and protected by Reed Elsevier Properties SA and used under license.

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Qualitative Results

Not Published

Measurement Parameter

Qualitative

Qualitative value

Not Published

Target, Subunit, Species carbonyl reductase (NADPH) Patent; SOUICHI MORIKAWA; NORIYUKI KIZAKI; MIHO YANO; MASAHIRO FUNAKI; TERUAKI TAKESUE; YOSHIHIKO YASOHARA; TAKAHISA NAKAI; MICHIHIKO KATAOKA; SAKAYU SHIMIZU; US2010/317075; (A1); (2010), View in Reaxys

31 of 42

Target Subunit Synonyms

carbonyl reductase; carbonyl reductase (nadph); nadph-dependent carbonyl reductase; nadph2-dependent carbonyl reductase; nonspecific nadph-dependent carbonyl reductase; secondary-alcohol:nadp+ oxidoreductase

Bioassay Category

In Vitro (Efficacy)

Bioassay Details

Percent relative reduction of compound (1 mM, dissolved in dimethyl sulfoxide) by Escherichia coli HB 101 (pNTOM3) in presence of NADPH (0.25 mM) upon incubation in 100 mM phosphate buffer, pH 6.5 for 1 min at 30 degree C when compared to control (CBPB)=100

Biological Species/NCBI Escherichia coli HB101 ID Substance RN

605573View in Reaxys

Measurement Parameter

Activity

Unit

%

Qualitative value

=

Quantitative value

8

Patent; SOUICHI MORIKAWA; NORIYUKI KIZAKI; MIHO YANO; MASAHIRO FUNAKI; TERUAKI TAKESUE; YOSHIHIKO YASOHARA; TAKAHISA NAKAI; MICHIHIKO KATAOKA; SAKAYU SHIMIZU; US2010/317075; (A1); (2010), View in Reaxys

32 of 42

Measurement Object

relative activity

Bioassay Category

In Vitro (Efficacy)

Bioassay Details

Percent relative reduction of compound (1 mM, dissolved in dimethyl sulfoxide) by Escherichia coli HB 101 (pNTOM4) in presence of NADPH (0.25 mM) upon incubation in 100 mM phosphate buffer, pH 6.5 for 1 min at 30 degree C when compared to control (CBPB)=100

Biological Species/NCBI Escherichia coli HB101 ID Substance RN

605573View in Reaxys

Measurement Parameter

Activity

Unit

%

Qualitative value

=

Quantitative value

0

Patent; SOUICHI MORIKAWA; NORIYUKI KIZAKI; MIHO YANO; MASAHIRO FUNAKI; TERUAKI TAKESUE; YOSHIHIKO YASOHARA; TAKAHISA NAKAI; MICHIHIKO KATAOKA; SAKAYU SHIMIZU; US2010/317075; (A1); (2010), View in Reaxys

33 of 42

Measurement Object

relative activity

Substance Effect

suppressive activity

Bioassay Category

In Vitro (Efficacy)

Bioassay Details

Effect of 0.25 uM compound on high-glucose induced protein expression (fibronectin and beta-actin) in rat glomerular mesangial cells in combination with 25 mM glucose upon incubation for 48 hr by WESTERN BLOT ASSAY and expressed as arbitrary units; high-glucose = 119 +/- 3.25

Biological Species/NCBI Rattus norvegicus ID

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Cells/Cell Lines

mesangium cell

Substance RN

605573View in Reaxys

Measurement Parameter

Qualitative

Qualitative value

Not Published

Ali Koubeissi; Assaad A. Eid; Fatima A. Mohsen; Georges Azzi; Joan Younes; Kamal H. Bouhadir; Mira Diab El-Harakeh; Rouba Cheaib; Bioorganic & medicinal chemistry letters; vol. 26; (2016); p. 1020 - 1024, View in Reaxys

34 of 42

Measurement Object

PROTEIN EXPRESSION

Substance Effect

suppressive activity

Bioassay Category

In Vitro (Efficacy)

Bioassay Details

Effect of 1 uM compound on high-glucose induced protein expression (fibronectin and beta-actin) in rat glomerular mesangial cells in combination with 25 mM glucose upon incubation for 48 hr by WESTERN BLOT ASSAY and expressed as arbitrary units; high-glucose = 119 +/- 3.25

Biological Species/NCBI Rattus norvegicus ID Cells/Cell Lines

mesangium cell

Substance RN

605573View in Reaxys

Measurement Parameter

Qualitative

Qualitative value

Not Published

Ali Koubeissi; Assaad A. Eid; Fatima A. Mohsen; Georges Azzi; Joan Younes; Kamal H. Bouhadir; Mira Diab El-Harakeh; Rouba Cheaib; Bioorganic & medicinal chemistry letters; vol. 26; (2016); p. 1020 - 1024, View in Reaxys

35 of 42

Measurement Object

PROTEIN EXPRESSION

Substance Effect

suppressive activity

Bioassay Category

In Vitro (Efficacy)

Bioassay Details

Effect of 0.5 uM compound on high-glucose induced protein expression (fibronectin and beta-actin) in rat glomerular mesangial cells in combination with 25 mM glucose upon incubation for 48 hr by WESTERN BLOT ASSAY and expressed as arbitrary units; high-glucose = 119 +/- 3.25

Biological Species/NCBI Rattus norvegicus ID Cells/Cell Lines

mesangium cell

Substance RN

605573View in Reaxys

Measurement Parameter

Qualitative

Qualitative value

Not Published

Ali Koubeissi; Assaad A. Eid; Fatima A. Mohsen; Georges Azzi; Joan Younes; Kamal H. Bouhadir; Mira Diab El-Harakeh; Rouba Cheaib; Bioorganic & medicinal chemistry letters; vol. 26; (2016); p. 1020 - 1024, View in Reaxys

36 of 42

Measurement Object

PROTEIN EXPRESSION

Substance Effect

suppressive activity

Bioassay Category

In Vitro (Efficacy)

Bioassay Details

Effect of 5 uM compound on high-glucose induced protein expression (fibronectin and beta-actin) in rat glomerular mesangial cells in combination with 25 mM glucose upon incubation for 48 hr by WESTERN BLOT ASSAY and expressed as arbitrary units; high-glucose = 119 +/- 3.25

Biological Species/NCBI Rattus norvegicus ID

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Cells/Cell Lines

mesangium cell

Substance RN

605573View in Reaxys

Measurement Parameter

Qualitative

Qualitative value

Not Published

Ali Koubeissi; Assaad A. Eid; Fatima A. Mohsen; Georges Azzi; Joan Younes; Kamal H. Bouhadir; Mira Diab El-Harakeh; Rouba Cheaib; Bioorganic & medicinal chemistry letters; vol. 26; (2016); p. 1020 - 1024, View in Reaxys

37 of 42

Measurement Object

PROTEIN EXPRESSION

Bioassay Category

In Vitro (Efficacy)

Biological Species/NCBI Rattus norvegicus ID Cells/Cell Lines

mesangium cell

Substance RN

605573View in Reaxys

Substance Dose

0.5 μM

Measurement Parameter

Amount

Unit

no unit

Quantitative value

101.07

Bouhadir, Kamal H.; Koubeissi, Ali; Mohsen, Fatima A.; El-Harakeh, Mira Diab; Cheaib, Rouba; Younes, Joan; Azzi, Georges; Eid, Assaad A.; Bioorganic and Medicinal Chemistry Letters; vol. 26; nb. 3; (2016); p. 1020 1024, View in Reaxys

38 of 42

Measurement Object

relating to non glucose control group

Compound RN

1281608

Compound name

glucose

Compound role

IND

Bioassay Category

In Vitro (Efficacy)

Biological Species/NCBI Rattus norvegicus ID Cells/Cell Lines

mesangium cell

Substance RN

605573View in Reaxys

Substance Dose

1 μM

Measurement Parameter

Amount

Unit

no unit

Quantitative value

113.72

Bouhadir, Kamal H.; Koubeissi, Ali; Mohsen, Fatima A.; El-Harakeh, Mira Diab; Cheaib, Rouba; Younes, Joan; Azzi, Georges; Eid, Assaad A.; Bioorganic and Medicinal Chemistry Letters; vol. 26; nb. 3; (2016); p. 1020 1024, View in Reaxys

39 of 42

Measurement Object

relating to non glucose control group

Compound RN

1281608

Compound name

glucose

Compound role

IND

Bioassay Category

In Vitro (Efficacy)

Biological Species/NCBI Rattus norvegicus ID Cells/Cell Lines

mesangium cell

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Substance RN

605573View in Reaxys

Substance Dose

5 μM

Measurement Parameter

Amount

Unit

no unit

Quantitative value

129.19

Bouhadir, Kamal H.; Koubeissi, Ali; Mohsen, Fatima A.; El-Harakeh, Mira Diab; Cheaib, Rouba; Younes, Joan; Azzi, Georges; Eid, Assaad A.; Bioorganic and Medicinal Chemistry Letters; vol. 26; nb. 3; (2016); p. 1020 1024, View in Reaxys

40 of 42

Measurement Object

relating to non glucose control group

Compound RN

1281608

Compound name

glucose

Compound role

IND

Bioassay Category

In Vitro (Efficacy)

Biological Species/NCBI Rattus norvegicus ID Cells/Cell Lines

mesangium cell

Substance RN

605573View in Reaxys

Substance Dose

0.25 μM

Measurement Parameter

Amount

Unit

no unit

Quantitative value

82.79

Bouhadir, Kamal H.; Koubeissi, Ali; Mohsen, Fatima A.; El-Harakeh, Mira Diab; Cheaib, Rouba; Younes, Joan; Azzi, Georges; Eid, Assaad A.; Bioorganic and Medicinal Chemistry Letters; vol. 26; nb. 3; (2016); p. 1020 1024, View in Reaxys

41 of 42

Measurement Object

relating to non glucose control group

Compound RN

1281608

Compound name

glucose

Compound role

IND

Substance Effect

Cytotoxic

Bioassay Category

Toxicity/Safety Pharmacology

Cells/Cell Lines

HEK 293T

Substance RN

605573View in Reaxys

Substance Dose

50 μg/ml

Measurement Parameter

% Inhibition

Unit

%

Quantitative value

30

Measurement pX

2.86

Tanwar, Babita; Kumar, Asim; Yogeeswari, Perumal; Sriram, Dharmarajan; Chakraborti, Asit K.; Bioorganic and Medicinal Chemistry Letters; vol. 26; nb. 24; (2016); p. 5960 - 5966, View in Reaxys 42 of 42

Substance Effect

Anti-Tuberculosis

Bioassay Category

In Vitro (Efficacy)

Biological Species/NCBI Mycobacterium tuberculosis ID

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Substance RN

605573View in Reaxys

Substance Dose

0.4 - 25 μg/ml

Measurement Parameter

MIC

Unit

μg/ml

Quantitative value

6.25

Measurement pX

4.13

Tanwar, Babita; Kumar, Asim; Yogeeswari, Perumal; Sriram, Dharmarajan; Chakraborti, Asit K.; Bioorganic and Medicinal Chemistry Letters; vol. 26; nb. 24; (2016); p. 5960 - 5966, View in Reaxys

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