937-73-5 Purity
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Specification
The molecular formula is C10H11ClO2S.
Some synonyms include 93-77-6, [(4-Chloro-2,5-dimethylphenyl)thio]acetic acid, and 2-(4-chloro-2,5-dimethylphenyl)sulfanylacetic acid.
The molecular weight is 230.71 g/mol.
It was created on August 8, 2005.
It was last modified on December 30, 2023.
The IUPAC name is 2-(4-chloro-2,5-dimethylphenyl)sulfanylacetic acid.
The InChI is InChI=1S/C10H11ClO2S/c1-6-4-9(14-5-10(12)13)7(2)3-8(6)11/h3-4H,5H2,1-2H3,(H,12,13).
The InChIKey is OEEPIGFTISQIKQ-UHFFFAOYSA-N.
The canonical SMILES is CC1=CC(=C(C=C1Cl)C)SCC(=O)O.
The CAS number is 93-77-6.