2-[[(4-Cyanophenyl)methyl]thio]acetic acid

CAS Registry Number®

178270-52-5
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CAS Name

2-[[(4-Cyanophenyl)methyl]thio]acetic acid

Molecular Formula

C10H9NO2S

Molecular Mass

207.25

Cite this Page

2-[[(4-Cyanophenyl)methyl]thio]acetic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=178270-52-5 (retrieved 2024-09-08) (CAS RN: 178270-52-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C10H9NO2S/c11-5-8-1-3-9(4-2-8)6-14-7-10(12)13/h1-4H,6-7H2,(H,12,13)

InChIKey

InChIKey=YAPZRBCKDSHRQX-UHFFFAOYSA-N

SMILES

C(SCC(O)=O)C1=CC=C(C#N)C=C1

Canonical SMILES

N#CC1=CC=C(C=C1)CSCC(=O)O

Other Names for this Substance

  • Acetic acid, 2-[[(4-cyanophenyl)methyl]thio]-
  • Acetic acid, [[(4-cyanophenyl)methyl]thio]-
  • 2-[[(4-Cyanophenyl)methyl]thio]acetic acid
  • 4-Cyanobenzylthioacetic acid
  • 2-[[(4-Cyanophenyl)methyl]sulfanyl]acetic acid