3-(3-Methyl-5-isothiazolyl)benzoic acid
CAS Registry Number®
1401522-26-6
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CAS Name
3-(3-Methyl-5-isothiazolyl)benzoic acidMolecular Formula
C11H9NO2SMolecular Mass
219.26Cite this Page
3-(3-Methyl-5-isothiazolyl)benzoic acid. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=1401522-26-6 (retrieved ) (CAS RN: 1401522-26-6). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C11H9NO2S/c1-7-5-10(15-12-7)8-3-2-4-9(6-8)11(13)14/h2-6H,1H3,(H,13,14)
InChIKey
InChIKey=MBFMJFWECSIPFN-UHFFFAOYSA-N
SMILES
C(O)(=O)C=1C=C(C=CC1)C=2SN=C(C)C2
Canonical SMILES
O=C(O)C1=CC=CC(=C1)C=2SN=C(C2)C
Other Names for this Substance
- Benzoic acid, 3-(3-methyl-5-isothiazolyl)-
- 3-(3-Methyl-5-isothiazolyl)benzoic acid