2-[(6-Chloro-1H-benzimidazol-2-yl)thio]acetic acid

CAS Registry Number®

5450-31-7

CAS Name

2-[(6-Chloro-1H-benzimidazol-2-yl)thio]acetic acid

Molecular Formula

C9H7ClN2O2S

Molecular Mass

242.68

Cite this Page

2-[(6-Chloro-1H-benzimidazol-2-yl)thio]acetic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=5450-31-7 (retrieved 2024-12-02) (CAS RN: 5450-31-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    193-194 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C9H7ClN2O2S/c10-5-1-2-6-7(3-5)12-9(11-6)15-4-8(13)14/h1-3H,4H2,(H,11,12)(H,13,14)

InChIKey

InChIKey=GBMGBPADBDLEKL-UHFFFAOYSA-N

SMILES

S(CC(O)=O)C=1NC=2C(N1)=CC(Cl)=CC2

Canonical SMILES

O=C(O)CSC1=NC=2C=C(Cl)C=CC2N1

Other Names for this Substance

  • Acetic acid, 2-[(6-chloro-1H-benzimidazol-2-yl)thio]-
  • Acetic acid, [(5-chloro-2-benzimidazolyl)thio]-
  • Acetic acid, [(5-chloro-1H-benzimidazol-2-yl)thio]-
  • Acetic acid, [5(or 6)-chloro-2-benzimidazolylthio]-
  • 2-[(6-Chloro-1H-benzimidazol-2-yl)thio]acetic acid

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