2-(4-chlorophenyl)sulfanyl-3,3-dimethylbutanoic acid

Modify Date: 2024-04-03 19:12:00

2-(4-chlorophenyl)sulfanyl-3,3-dimethylbutanoic acid Structure
2-(4-chlorophenyl)sulfanyl-3,3-dimethylbutanoic acid structure
Common Name 2-(4-chlorophenyl)sulfanyl-3,3-dimethylbutanoic acid
CAS Number 110577-63-4 Molecular Weight 258.76400
Density 1.23g/cm3 Boiling Point 374ºC at 760 mmHg
Molecular Formula C12H15ClO2S Melting Point N/A
MSDS N/A Flash Point 180ºC

 Names

Name 2-(4-chlorophenyl)sulfanyl-3,3-dimethylbutanoic acid
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.23g/cm3
Boiling Point 374ºC at 760 mmHg
Molecular Formula C12H15ClO2S
Molecular Weight 258.76400
Flash Point 180ºC
Exact Mass 258.04800
PSA 62.60000
LogP 3.93140
Vapour Pressure 2.94E-06mmHg at 25°C
Index of Refraction 1.572
InChIKey JBTVHAOPCCDXOP-UHFFFAOYSA-N
SMILES CC(C)(C)C(Sc1ccc(Cl)cc1)C(=O)O

 Synonyms

Butanoic acid,2-[(4-chlorophenyl)thio]-3,3-dimethyl
2-[(4-chlorophenyl)sulfanyl]-3,3-dimethylbutanoic acid
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