1-(2-Methylphenyl)-4-oxocyclohexanecarbonitrile

Modify Date: 2025-08-25 12:11:07

1-(2-Methylphenyl)-4-oxocyclohexanecarbonitrile Structure
1-(2-Methylphenyl)-4-oxocyclohexanecarbonitrile structure
Common Name 1-(2-Methylphenyl)-4-oxocyclohexanecarbonitrile
CAS Number 65619-09-2 Molecular Weight 213.275
Density 1.1±0.1 g/cm3 Boiling Point 389.7±42.0 °C at 760 mmHg
Molecular Formula C14H15NO Melting Point N/A
MSDS N/A Flash Point 189.5±27.9 °C

 Names

Name 1-(2-methylphenyl)-4-oxocyclohexane-1-carbonitrile
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.1±0.1 g/cm3
Boiling Point 389.7±42.0 °C at 760 mmHg
Molecular Formula C14H15NO
Molecular Weight 213.275
Flash Point 189.5±27.9 °C
Exact Mass 213.115356
PSA 40.86000
LogP 2.00
Vapour Pressure 0.0±0.9 mmHg at 25°C
Index of Refraction 1.552
InChIKey ALYQPOYEXMIQDZ-UHFFFAOYSA-N
SMILES Cc1ccccc1C1(C#N)CCC(=O)CC1

 Safety Information

HS Code 2926909090

 Synthetic Route

~80%

1-(2-Methylphenyl)-4-oxocyclohexanecarbonitrile Structure

1-(2-Methylphen...

CAS#:65619-09-2

Literature: Lednicer, Daniel; VonVoigtlander, Philip F.; Emmert, D. Edward Journal of Medicinal Chemistry, 1980 , vol. 23, # 4 p. 424 - 430

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1-(2-Methylphenyl)-4-oxocyclohexanecarbonitrile Structure

1-(2-Methylphen...

CAS#:65619-09-2

Literature: The Upjohn Company Patent: US4065573 A1, 1977 ;

 Precursor & DownStream

Precursor  1

DownStream  0

 Customs

HS Code 2926909090
Summary HS:2926909090 other nitrile-function compounds VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

 Synonyms

4-methylphenyl-4-cyano-cyclohexanone
4-Cyano-4-(o-tolyl)-cyclohexanon
4-oxo-1-o-tolylcyclohexanecarbonitrile
1-cyano-1-(2-methylphenyl)cyclohexan-4-one
Cyclohexanecarbonitrile, 1-(2-methylphenyl)-4-oxo-
1-(2-Methylphenyl)-4-oxocyclohexanecarbonitrile
4-cyano-4-(o-tolyl)cyclohexanone
4-Cyano-4-(2-methylphenyl)cyclohexanone
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