4-[(2-Pyridinylthio)methyl]benzoic acid

CAS Registry Number®

82145-80-0
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CAS Name

4-[(2-Pyridinylthio)methyl]benzoic acid

Molecular Formula

C13H11NO2S

Molecular Mass

245.30

Cite this Page

4-[(2-Pyridinylthio)methyl]benzoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=82145-80-0 (retrieved 2024-05-03) (CAS RN: 82145-80-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C13H11NO2S/c15-13(16)11-6-4-10(5-7-11)9-17-12-3-1-2-8-14-12/h1-8H,9H2,(H,15,16)

InChIKey

InChIKey=WVJPZRUUOGYPAV-UHFFFAOYSA-N

SMILES

C(SC1=CC=CC=N1)C2=CC=C(C(O)=O)C=C2

Canonical SMILES

O=C(O)C1=CC=C(C=C1)CSC2=NC=CC=C2

Other Names for this Substance

  • Benzoic acid, 4-[(2-pyridinylthio)methyl]-
  • 4-[(2-Pyridinylthio)methyl]benzoic acid

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