4-(5-Isothiazolyl)benzoic acid
CAS Registry Number®
904085-97-8
CAS Name
4-(5-Isothiazolyl)benzoic acidMolecular Formula
C10H7NO2SMolecular Mass
205.23Cite 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 ) (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