Butanoic acid,2,2-dimethyl-3-oxo-, ethyl ester

Modify Date: 2025-08-26 11:00:14

Butanoic acid,2,2-dimethyl-3-oxo-, ethyl ester Structure
Butanoic acid,2,2-dimethyl-3-oxo-, ethyl ester structure
Common Name Butanoic acid,2,2-dimethyl-3-oxo-, ethyl ester
CAS Number 597-04-6 Molecular Weight 158.19500
Density 0.976g/cm3 Boiling Point 262.9ºC at 760mmHg
Molecular Formula C8H14O3 Melting Point N/A
MSDS N/A Flash Point 113.7ºC

 Names

Name ethyl 2,2-dimethyl-3-oxobutanoate
Synonym More Synonyms

 Chemical & Physical Properties

Density 0.976g/cm3
Boiling Point 262.9ºC at 760mmHg
Molecular Formula C8H14O3
Molecular Weight 158.19500
Flash Point 113.7ºC
Exact Mass 158.09400
PSA 43.37000
LogP 1.16470
Index of Refraction 1.42
InChIKey NVAHZHOCRQCUBY-UHFFFAOYSA-N
SMILES CCOC(=O)C(C)(C)C(C)=O

 Safety Information

Hazard Codes Xn
Risk Phrases 22-36/37/38
Safety Phrases 22-26-36/37/39

 Synthetic Route

 Synonyms

2,2-dimethyl-acetoacetic acid ethyl ester
ethyl-2,2-dimethyl-3-oxobutanone
2,2-Dimethyl-acetessigsaeure-aethylester
2,2-DIMETHYL-3-OXO-BUTYRIC ACID ETHYL ESTER
ethyl 2,2-dimethylacetoacetate
ethyl 2,2-dimethyl-3-oxobutyrate
Butanoic acid,2,2-dimethyl-3-oxo-,ethyl ester
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