2-[(4-Chloro-2-methylphenyl)thio]acetic acid

CAS Registry Number®

94-76-8
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CAS Name

2-[(4-Chloro-2-methylphenyl)thio]acetic acid

Molecular Formula

C9H9ClO2S

Molecular Mass

216.68

Cite this Page

2-[(4-Chloro-2-methylphenyl)thio]acetic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=94-76-8 (retrieved 2024-05-20) (CAS RN: 94-76-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    127-129 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C9H9ClO2S/c1-6-4-7(10)2-3-8(6)13-5-9(11)12/h2-4H,5H2,1H3,(H,11,12)

InChIKey

InChIKey=GREQGIILILTWOH-UHFFFAOYSA-N

SMILES

S(CC(O)=O)C1=C(C)C=C(Cl)C=C1

Canonical SMILES

O=C(O)CSC1=CC=C(Cl)C=C1C

Other Names for this Substance

  • Acetic acid, 2-[(4-chloro-2-methylphenyl)thio]-
  • Acetic acid, [(4-chloro-o-tolyl)thio]-
  • Acetic acid, [(4-chloro-2-methylphenyl)thio]-
  • 2-[(4-Chloro-2-methylphenyl)thio]acetic acid
  • (4-Chloro-o-tolylmercapto)acetic acid

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