4-Cyclohexene-1,2-diacetonitrile,(1R,2S)-rel-

Modify Date: 2025-12-02 10:37:23

4-Cyclohexene-1,2-diacetonitrile,(1R,2S)-rel- Structure
4-Cyclohexene-1,2-diacetonitrile,(1R,2S)-rel- structure
Common Name 4-Cyclohexene-1,2-diacetonitrile,(1R,2S)-rel-
CAS Number 25886-61-7 Molecular Weight 160.21600
Density 0.991g/cm3 Boiling Point 346.3ºC at 760mmHg
Molecular Formula C10H12N2 Melting Point N/A
MSDS N/A Flash Point 169ºC

 Names

Name 2-[6-(cyanomethyl)cyclohex-3-en-1-yl]acetonitrile
Synonym More Synonyms

 Chemical & Physical Properties

Density 0.991g/cm3
Boiling Point 346.3ºC at 760mmHg
Molecular Formula C10H12N2
Molecular Weight 160.21600
Flash Point 169ºC
Exact Mass 160.10000
PSA 47.58000
LogP 2.39616
Vapour Pressure 5.83E-05mmHg at 25°C
Index of Refraction 1.477
InChIKey VDPLYCACVIFCHQ-UHFFFAOYSA-N
SMILES N#CCC1CC=CCC1CC#N

 Synthetic Route

~78%

4-Cyclohexene-1,2-diacetonitrile,(1R,2S)-rel- Structure

4-Cyclohexene-1...

CAS#:25886-61-7

Literature: Mundy,B.P.; Theodore,J.J. Journal of the American Chemical Society, 1980 , vol. 102, p. 2005

~%

4-Cyclohexene-1,2-diacetonitrile,(1R,2S)-rel- Structure

4-Cyclohexene-1...

CAS#:25886-61-7

Literature: Banerjee,D.K.; Ram,K.S. Indian Journal of Chemistry, 1972 , vol. 10, p. 1 - 8

~%

4-Cyclohexene-1,2-diacetonitrile,(1R,2S)-rel- Structure

4-Cyclohexene-1...

CAS#:25886-61-7

Literature: Xie; Funakoshi; Suemune; et al. Chemical and Pharmaceutical Bulletin, 1986 , vol. 34, # 7 p. 3058 - 3060

~%

4-Cyclohexene-1,2-diacetonitrile,(1R,2S)-rel- Structure

4-Cyclohexene-1...

CAS#:25886-61-7

Literature: Xie; Funakoshi; Suemune; et al. Chemical and Pharmaceutical Bulletin, 1986 , vol. 34, # 7 p. 3058 - 3060

~%

4-Cyclohexene-1,2-diacetonitrile,(1R,2S)-rel- Structure

4-Cyclohexene-1...

CAS#:25886-61-7

Literature: Xie; Funakoshi; Suemune; et al. Chemical and Pharmaceutical Bulletin, 1986 , vol. 34, # 7 p. 3058 - 3060

 Synonyms

cis-4,5-Bis(cyanomethyl)cyclohexene
(cis-cyclohex-4-ene-1,2-diyl)-di-acetonitrile
2,2'-cyclohex-4-ene-1,2-diyldiacetonitrile
(cis-Cyclohex-4-en-1,2-diyl)-di-acetonitril
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