3-(1-cyanoethyl)benzoyl chloride

Modify Date: 2026-07-15 11:02:37

3-(1-cyanoethyl)benzoyl chloride Structure
3-(1-cyanoethyl)benzoyl chloride structure
Common Name 3-(1-cyanoethyl)benzoyl chloride
CAS Number 42872-29-7 Molecular Weight 193.63000
Density 1.215g/cm3 Boiling Point 305.9ºC at 760 mmHg
Molecular Formula C10H8ClNO Melting Point N/A
MSDS N/A Flash Point 138.8ºC

 Names

Name 3-(1-cyanoethyl)benzoyl chloride
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.215g/cm3
Boiling Point 305.9ºC at 760 mmHg
Molecular Formula C10H8ClNO
Molecular Weight 193.63000
Flash Point 138.8ºC
Exact Mass 193.02900
PSA 40.86000
LogP 2.69268
Index of Refraction 1.548
InChIKey XXQNFMGCPMJJSJ-UHFFFAOYSA-N
SMILES CC(C#N)c1cccc(C(=O)Cl)c1

 Safety Information

HS Code 2926909090

 Synthetic Route

~99%

3-(1-cyanoethyl)benzoyl chloride Structure

3-(1-cyanoethyl...

CAS#:42872-29-7

Learn More
Literature: DOMPE' S.P.A. Patent: WO2006/63999 A1, 2006 ; Location in patent: Page/Page column 14-15 ; WO 2006/063999 A1

 Precursor & DownStream

Precursor  1

DownStream  1

 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

einecs 255-980-4
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