4-[(Methylsulfanyl)methyl]benzoic acid structure

4-[(Methylsulfanyl)methyl]benzoic acid

4-(methylsulfanylmethyl)benzoic acid

Also Known As: 4-[(Methylsulfanyl)methyl]benzoic acid|4-((Methylthio)methyl)benzoic acid|4-[(methylthio)methyl]benzoic acid|ACMC-209nxe|4-(methylsulfanylmethyl)benzoic Acid|4-[ methyl]benzoicacid|4-(Methylthiomethyl)benzoic acid|4-((Methylthio)methyl)benzoicacid|4-(methylsulfanyl)methylbenzoic acid|0287AC|KM1056|Benzoic acid,4-[(methylthio)methyl]-|4-((methylsulfanyl)methyl)benzoic acid|NCGC00341601-01|J1.228.798D|Bis(2,4-dimethylpentane-2,4-glycolato)diboron|AB01332711-02|I01-11594|979-032-0

CAS: 67003-48-9
Molecular Formula C9H10O2S
Molecular Weight 182.04015 g/mol
LogP 2.2478
Topological Polar Surface Area 37.3 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 2
Rotatable Bonds 3
Exact Mass 182.04015
Monoisotopic Mass 182.04015
Heavy Atoms 12
Complexity 266.36197

Chemical Identifiers

CAS Number 67003-48-9
SMILES CSCC1=CC=C(C=C1)C(=O)O

Product Overview

4-[(Methylsulfanyl)methyl]benzoic acid (CAS 67003-48-9), with molecular formula C9H10O2S and molecular weight 182.04015 g/mol. IUPAC: 4-(methylsulfanylmethyl)benzoic acid.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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