3-(Methylsulfonyl)benzonitrile

Modify Date: 2024-01-01 17:42:45

3-(Methylsulfonyl)benzonitrile Structure
3-(Methylsulfonyl)benzonitrile structure
Common Name 3-(Methylsulfonyl)benzonitrile
CAS Number 22821-75-6 Molecular Weight 181.21200
Density 1.32g/cm3 Boiling Point 378.1ºC at 760 mmHg
Molecular Formula C8H7NO2S Melting Point 103-104 ºC
MSDS N/A Flash Point 182.5ºC

 Names

Name 3-methylsulfonylbenzonitrile
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.32g/cm3
Boiling Point 378.1ºC at 760 mmHg
Melting Point 103-104 ºC
Molecular Formula C8H7NO2S
Molecular Weight 181.21200
Flash Point 182.5ºC
Exact Mass 181.02000
PSA 66.31000
LogP 2.04258
Vapour Pressure 6.45E-06mmHg at 25°C
Index of Refraction 1.57
Water Solubility Slightly soluble (1.3 g/L) (25 ºC)

 Safety Information

Hazard Codes Xi: Irritant;
HS Code 2926909090

 Synthetic Route

~89%

3-(Methylsulfonyl)benzonitrile Structure

3-(Methylsulfon...

CAS#:22821-75-6

Literature: Hanson, Peter; Hendrickx, Ramon A. A. J.; Smith, John R. Lindsay Organic and Biomolecular Chemistry, 2008 , vol. 6, # 6 p. 745 - 761

~%

3-(Methylsulfonyl)benzonitrile Structure

3-(Methylsulfon...

CAS#:22821-75-6

Literature: Journal of the American Chemical Society, , vol. 115, # 17 p. 7584 - 7592

~%

3-(Methylsulfonyl)benzonitrile Structure

3-(Methylsulfon...

CAS#:22821-75-6

Literature: Journal of the Chemical Society, , p. 633,639

~%

3-(Methylsulfonyl)benzonitrile Structure

3-(Methylsulfon...

CAS#:22821-75-6

Literature: Journal of the Chemical Society, , p. 633,639

~%

3-(Methylsulfonyl)benzonitrile Structure

3-(Methylsulfon...

CAS#:22821-75-6

Literature: Journal of the Chemical Society, , p. 763,766

~%

3-(Methylsulfonyl)benzonitrile Structure

3-(Methylsulfon...

CAS#:22821-75-6

Literature: Journal of the Chemical Society, , p. 763,766

~%

3-(Methylsulfonyl)benzonitrile Structure

3-(Methylsulfon...

CAS#:22821-75-6

Literature: US2005/256145 A1, ; Page/Page column 36 ;

 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

3-Methylsulfon-benzoesaeure-nitril
3-Methylsulfonylbenzonitrile
3-Methylsulfon-benzonitril
3-methanesulfonylbenzonitrile
3-Methansulfonyl-benzonitril
3-cyanophenyl methyl sulfone
4-(Methylsulfonyl)benzoicacid
3-(Methylsulfonyl)benzonitrile