2-[2-chloro-4-[(2-methylpropan-2-yl)oxycarbonyl]phenyl]sulfanylacetic acid

Modify Date: 2025-08-26 18:34:27

2-[2-chloro-4-[(2-methylpropan-2-yl)oxycarbonyl]phenyl]sulfanylacetic acid Structure
2-[2-chloro-4-[(2-methylpropan-2-yl)oxycarbonyl]phenyl]sulfanylacetic acid structure
Common Name 2-[2-chloro-4-[(2-methylpropan-2-yl)oxycarbonyl]phenyl]sulfanylacetic acid
CAS Number 921211-97-4 Molecular Weight 302.77400
Density N/A Boiling Point N/A
Molecular Formula C13H15ClO4S Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name 2-[2-chloro-4-[(2-methylpropan-2-yl)oxycarbonyl]phenyl]sulfanylacetic acid
Synonym More Synonyms

 Chemical & Physical Properties

Molecular Formula C13H15ClO4S
Molecular Weight 302.77400
Exact Mass 302.03800
PSA 88.90000
LogP 3.47200
InChIKey JVMMNANGZZYQEO-UHFFFAOYSA-N
SMILES CC(C)(C)OC(=O)c1ccc(SCC(=O)O)c(Cl)c1

 Synthetic Route

~%

2-[2-chloro-4-[(2-methylpropan-2-yl)oxycarbonyl]phenyl]sulfanylacetic acid Structure

2-[2-chloro-4-[...

CAS#:921211-97-4

Literature: ASTRAZENECA AB Patent: WO2007/11292 A1, 2007 ; Location in patent: Page/Page column 36-37 ; WO 2007/011292 A1

 Synonyms

4-carboxymethylsulfanyl-3-chlorobenzoic acid tert-butyl ester
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