3-Cyclopentyl-3-oxopropanenitrile

Modify Date: 2024-01-11 17:18:54

3-Cyclopentyl-3-oxopropanenitrile Structure
3-Cyclopentyl-3-oxopropanenitrile structure
Common Name 3-Cyclopentyl-3-oxopropanenitrile
CAS Number 95882-33-0 Molecular Weight 137.179
Density 1.1±0.1 g/cm3 Boiling Point 229.5±13.0 °C at 760 mmHg
Molecular Formula C8H11NO Melting Point N/A
MSDS N/A Flash Point 92.6±19.8 °C

 Names

Name 3-Cyclopentyl-3-oxopropanenitrile
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.1±0.1 g/cm3
Boiling Point 229.5±13.0 °C at 760 mmHg
Molecular Formula C8H11NO
Molecular Weight 137.179
Flash Point 92.6±19.8 °C
Exact Mass 137.084061
PSA 40.86000
LogP 0.81
Vapour Pressure 0.1±0.5 mmHg at 25°C
Index of Refraction 1.479

 Safety Information

Hazard Codes T
HS Code 2926909090

 Synthetic Route

~93%

3-Cyclopentyl-3-oxopropanenitrile Structure

3-Cyclopentyl-3...

CAS#:95882-33-0

Literature: Rowbottom, Martin W.; Faraoni, Raffaella; Chao, Qi; Campbell, Brian T.; Lai, Andiliy G.; Setti, Eduardo; Ezawa, Maiko; Sprankle, Kelly G.; Abraham, Sunny; Tran, Lan; Struss, Brian; Gibney, Michael; Armstrong, Robert C.; Gunawardane, Ruwanthi N.; Nepomuceno, Ronald R.; Valenta, Ianina; Hua, Helen; Gardner, Michael F.; Cramer, Merryl D.; Gitnick, Dana; Insko, Darren E.; Apuy, Julius L.; Jones-Bolin, Susan; Ghose, Arup K.; Herbertz, Torsten; Ator, Mark A.; Dorsey, Bruce D.; Ruggeri, Bruce; Williams, Michael; Bhagwat, Shripad; James, Joyce; Holladay, Mark W. Journal of Medicinal Chemistry, 2012 , vol. 55, # 3 p. 1082 - 1105

~99%

3-Cyclopentyl-3-oxopropanenitrile Structure

3-Cyclopentyl-3...

CAS#:95882-33-0

Literature: European Molecular Biology Laboratory; F. Hoffmann-La Roche AG; WOLKERSTORFER, Andrea; SZOLAR, Oliver; HANDLER, Norbert; CUSACK, Stephen; SAUVAITRE, Thibault; SIMON, Céline; MORICE, Christophe; GIETHLEN, Bruno; LANGER, Thierry; SMITH, Mark; SO, Sung-Sau; CLASSEN-HOUBEN, Dirk; BUSCHMANN, Helmut Patent: US2013/317022 A1, 2013 ; Location in patent: Paragraph 0542-0544 ;

~%

3-Cyclopentyl-3-oxopropanenitrile Structure

3-Cyclopentyl-3...

CAS#:95882-33-0

Literature: US2008/4302 A1, ; Page/Page column 52-53 ; US 20080004302 A1

 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

Cyclopentanepropanenitrile, β-oxo-
3-Cyclopentyl-3-oxopropanenitrile