Ethyl 3-(3,3-dimethyl-1-butyn-1-yl)benzoate

Modify Date: 2025-09-25 15:01:48

Ethyl 3-(3,3-dimethyl-1-butyn-1-yl)benzoate Structure
Ethyl 3-(3,3-dimethyl-1-butyn-1-yl)benzoate structure
Common Name Ethyl 3-(3,3-dimethyl-1-butyn-1-yl)benzoate
CAS Number 878744-48-0 Molecular Weight 230.302
Density 1.0±0.1 g/cm3 Boiling Point 333.2±25.0 °C at 760 mmHg
Molecular Formula C15H18O2 Melting Point N/A
MSDS N/A Flash Point 138.0±20.6 °C

 Names

Name Ethyl 3-(3,3-dimethyl-1-butyn-1-yl)benzoate
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.0±0.1 g/cm3
Boiling Point 333.2±25.0 °C at 760 mmHg
Molecular Formula C15H18O2
Molecular Weight 230.302
Flash Point 138.0±20.6 °C
Exact Mass 230.130676
LogP 4.86
Vapour Pressure 0.0±0.7 mmHg at 25°C
Index of Refraction 1.521
InChIKey GYRLLMXGYYZGER-UHFFFAOYSA-N
SMILES CCOC(=O)c1cccc(C#CC(C)(C)C)c1

 Synonyms

Benzoic acid, 3-(3,3-dimethyl-1-butyn-1-yl)-, ethyl ester
Ethyl 3-(3,3-dimethyl-1-butyn-1-yl)benzoate
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