2-(2-chlorophenyl)-4-oxo-4-phenyl-butanenitrile

Modify Date: 2025-09-12 12:06:59

2-(2-chlorophenyl)-4-oxo-4-phenyl-butanenitrile Structure
2-(2-chlorophenyl)-4-oxo-4-phenyl-butanenitrile structure
Common Name 2-(2-chlorophenyl)-4-oxo-4-phenyl-butanenitrile
CAS Number 3300-68-3 Molecular Weight 269.72600
Density 1.221g/cm3 Boiling Point 448.7ºC at 760 mmHg
Molecular Formula C16H12ClNO Melting Point N/A
MSDS N/A Flash Point 225.1ºC

 Names

Name 2-(2-chlorophenyl)-4-oxo-4-phenylbutanenitrile
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.221g/cm3
Boiling Point 448.7ºC at 760 mmHg
Molecular Formula C16H12ClNO
Molecular Weight 269.72600
Flash Point 225.1ºC
Exact Mass 269.06100
PSA 40.86000
LogP 4.22018
Index of Refraction 1.593
InChIKey IERKUBFHQMKYFL-UHFFFAOYSA-N
SMILES N#CC(CC(=O)c1ccccc1)c1ccccc1Cl

 Safety Information

HS Code 2926909090

 Synthetic Route

~69%

2-(2-chlorophenyl)-4-oxo-4-phenyl-butanenitrile Structure

2-(2-chlorophen...

CAS#:3300-68-3

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Literature: Ramesh, Samikannu; Lalitha, Appaswami Acta Chimica Slovenica, 2013 , vol. 60, # 3 p. 689 - 694

~91%

2-(2-chlorophenyl)-4-oxo-4-phenyl-butanenitrile Structure

2-(2-chlorophen...

CAS#:3300-68-3

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Literature: Lin, Shaoxia; Wei, Ying; Liang, Fushun Chemical Communications, 2012 , vol. 48, # 79 p. 9879 - 9881

~96%

2-(2-chlorophenyl)-4-oxo-4-phenyl-butanenitrile Structure

2-(2-chlorophen...

CAS#:3300-68-3

Learn More
Literature: Yang, Jingya; Chen, Fuxue Chinese Journal of Chemistry, 2010 , vol. 28, # 6 p. 981 - 987

~%

2-(2-chlorophenyl)-4-oxo-4-phenyl-butanenitrile Structure

2-(2-chlorophen...

CAS#:3300-68-3

Learn More
Literature: Davis Journal of Organic Chemistry, 1959 , vol. 24, p. 880

 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

(phenyl)-[2-(2-chlorophenyl)-2-cyanoethyl]-ketone
2-(2-chloro-phenyl)-4-oxo-4-phenyl-butyronitrile
2-(2-Chlor-phenyl)-4-oxo-4-phenyl-butyronitril
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