Benzeneacetonitrile,4-(phenylthio)-

Modify Date: 2024-01-13 20:38:00

Benzeneacetonitrile,4-(phenylthio)- Structure
Benzeneacetonitrile,4-(phenylthio)- structure
Common Name Benzeneacetonitrile,4-(phenylthio)-
CAS Number 6317-59-5 Molecular Weight 225.30900
Density 1.18g/cm3 Boiling Point 405.1ºC at 760 mmHg
Molecular Formula C14H11NS Melting Point N/A
MSDS N/A Flash Point 198.8ºC

 Names

Name 2-(4-phenylsulfanylphenyl)acetonitrile
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.18g/cm3
Boiling Point 405.1ºC at 760 mmHg
Molecular Formula C14H11NS
Molecular Weight 225.30900
Flash Point 198.8ºC
Exact Mass 225.06100
PSA 49.09000
LogP 3.90388
Index of Refraction 1.639

 Synthetic Route

~96%

Benzeneacetonitrile,4-(phenylthio)- Structure

Benzeneacetonit...

CAS#:6317-59-5

Literature: Sikazwe, Donald; Bondarev, Mikhail L.; Dukat, Malgorzata; Rangisetty, Jagadeesh B.; Roth, Bryan L.; Glennon, Richard A. Journal of Medicinal Chemistry, 2006 , vol. 49, # 17 p. 5217 - 5225

~%

Benzeneacetonitrile,4-(phenylthio)- Structure

Benzeneacetonit...

CAS#:6317-59-5

Literature: Otsuka Pharmaceutical Co., Ltd. Patent: US5420128 A1, 1995 ;

~%

Benzeneacetonitrile,4-(phenylthio)- Structure

Benzeneacetonit...

CAS#:6317-59-5

Literature: Sikazwe, Donald; Bondarev, Mikhail L.; Dukat, Malgorzata; Rangisetty, Jagadeesh B.; Roth, Bryan L.; Glennon, Richard A. Journal of Medicinal Chemistry, 2006 , vol. 49, # 17 p. 5217 - 5225

~%

Benzeneacetonitrile,4-(phenylthio)- Structure

Benzeneacetonit...

CAS#:6317-59-5

Literature: Sikazwe, Donald; Bondarev, Mikhail L.; Dukat, Malgorzata; Rangisetty, Jagadeesh B.; Roth, Bryan L.; Glennon, Richard A. Journal of Medicinal Chemistry, 2006 , vol. 49, # 17 p. 5217 - 5225

~%

Benzeneacetonitrile,4-(phenylthio)- Structure

Benzeneacetonit...

CAS#:6317-59-5

Literature: Hoffmann-La Roche Patent: US2489348 , 1947 ;

~%

Benzeneacetonitrile,4-(phenylthio)- Structure

Benzeneacetonit...

CAS#:6317-59-5

Detail
Literature: Dneprovskii, A. S.; Tuchkin, A. I. Russian Journal of Organic Chemistry, 1994 , vol. 30, # 3.2 p. 435 - 441 Zhurnal Organicheskoi Khimii, 1994 , vol. 30, # 3 p. 404 - 410

 Synonyms

4-phenylthiobenzyl cyanide
(4-Phenylmercapto-phenyl)-acetonitril
4-phenylthiophenylacetonitrile
1-cyanomethyl-4-phenylthiobenzene
Benzeneacetonitrile,4-(phenylthio)
[4-(phenylsulfanyl)phenyl]acetonitrile
4-Phenyl-thiobenzylcyanid