3-chloro-4,4-dimethylpent-2-enenitrile

Modify Date: 2025-08-25 11:36:35

3-chloro-4,4-dimethylpent-2-enenitrile Structure
3-chloro-4,4-dimethylpent-2-enenitrile structure
Common Name 3-chloro-4,4-dimethylpent-2-enenitrile
CAS Number 216574-58-2 Molecular Weight 143.61400
Density 1.009g/cm3 Boiling Point 193.6ºC at 760mmHg
Molecular Formula C7H10ClN Melting Point N/A
MSDS N/A Flash Point 58.2ºC

 Names

Name 3-chloro-4,4-dimethylpent-2-enenitrile
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.009g/cm3
Boiling Point 193.6ºC at 760mmHg
Molecular Formula C7H10ClN
Molecular Weight 143.61400
Flash Point 58.2ºC
Exact Mass 143.05000
PSA 23.79000
LogP 2.67878
Vapour Pressure 0.46mmHg at 25°C
Index of Refraction 1.461
InChIKey KCVZJFYFJKNOFD-GQCTYLIASA-N
SMILES CC(C)(C)C(Cl)=CC#N

 Safety Information

Hazard Codes Xi: Irritant;
HS Code 2926909090

 Synthetic Route

~93%

3-chloro-4,4-dimethylpent-2-enenitrile Structure

3-chloro-4,4-di...

CAS#:216574-58-2

Literature: Bayer Corporation Patent: EP1019040 B1, 2004 ; Location in patent: Page/Page column 28-29 ;

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3-chloro-4,4-dimethylpent-2-enenitrile Structure

3-chloro-4,4-di...

CAS#:216574-58-2

Literature: Synthesis, , # 8 p. 1096 - 1100

~%

3-chloro-4,4-dimethylpent-2-enenitrile Structure

3-chloro-4,4-di...

CAS#:216574-58-2

Literature: Synthesis, , # 8 p. 1096 - 1100

 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

2-Pentenenitrile,3-chloro-4,4-dimethyl
3-tert-Butyl-3-chloroacrylonitrile
3-Chloro-4,4-dimethyl-2-pentenenitrile
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