2-Cyano-4,4-dimethyl-pent-2-enoic acid

Modify Date: 2025-11-25 20:24:27

2-Cyano-4,4-dimethyl-pent-2-enoic acid Structure
2-Cyano-4,4-dimethyl-pent-2-enoic acid structure
Common Name 2-Cyano-4,4-dimethyl-pent-2-enoic acid
CAS Number 88319-37-3 Molecular Weight 153.17800
Density 1.078±0.06 g/cm3 Boiling Point 287.4±23.0 °C
Molecular Formula C8H11NO2 Melting Point 123.5-125 °C
MSDS N/A Flash Point N/A

 Names

Name 2-cyano-4,4-dimethylpent-2-enoic acid
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.078±0.06 g/cm3
Boiling Point 287.4±23.0 °C
Melting Point 123.5-125 °C
Molecular Formula C8H11NO2
Molecular Weight 153.17800
Exact Mass 153.07900
PSA 61.09000
LogP 1.56708
InChIKey NJCRQFJRXAZYEJ-UHFFFAOYSA-N
SMILES CC(C)(C)C=C(C#N)C(=O)O
Storage condition 2-8°C

 Safety Information

Hazard Codes C

 Synthetic Route

~%

2-Cyano-4,4-dimethyl-pent-2-enoic acid Structure

2-Cyano-4,4-dim...

CAS#:88319-37-3

Literature: PRINCIPIA BIOPHARMA INC.; GOLDSTEIN, David Michael; BRAMELD, Kenneth Albert Patent: WO2012/158810 A1, 2012 ; Location in patent: Page/Page column 108; 109 ; WO 2012/158810 A1

 Precursor & DownStream

Precursor  2

DownStream  0

 Synonyms

2-Pentenoic acid,2-cyano-4,4-dimethyl
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