4-(5-Isothiazolyl)benzoic acid

CAS Registry Number®

904085-97-8

CAS Name

4-(5-Isothiazolyl)benzoic acid

Molecular Formula

C10H7NO2S

Molecular Mass

205.23

Cite this Page

4-(5-Isothiazolyl)benzoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=904085-97-8 (retrieved 2024-11-24) (CAS RN: 904085-97-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C10H7NO2S/c12-10(13)8-3-1-7(2-4-8)9-5-6-11-14-9/h1-6H,(H,12,13)

InChIKey

InChIKey=VGSYPDUJBVLGGI-UHFFFAOYSA-N

SMILES

C(O)(=O)C1=CC=C(C=C1)C2=CC=NS2

Canonical SMILES

O=C(O)C=1C=CC(=CC1)C=2SN=CC2

Other Names for this Substance

  • Benzoic acid, 4-(5-isothiazolyl)-
  • 4-(5-Isothiazolyl)benzoic acid

CAS INSIGHTSTM
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