2-Chloro-4-(2,5-dimethyl-1H-pyrrol-1-yl)benzoic acid

CAS Registry Number®

313701-79-0
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CAS Name

2-Chloro-4-(2,5-dimethyl-1H-pyrrol-1-yl)benzoic acid

Molecular Formula

C13H12ClNO2

Molecular Mass

249.69

Cite this Page

2-Chloro-4-(2,5-dimethyl-1H-pyrrol-1-yl)benzoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=313701-79-0 (retrieved 2024-07-08) (CAS RN: 313701-79-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C13H12ClNO2/c1-8-3-4-9(2)15(8)10-5-6-11(13(16)17)12(14)7-10/h3-7H,1-2H3,(H,16,17)

InChIKey

InChIKey=LNAUEAGSVLKUBO-UHFFFAOYSA-N

SMILES

CC=1N(C(C)=CC1)C2=CC(Cl)=C(C(O)=O)C=C2

Canonical SMILES

O=C(O)C1=CC=C(C=C1Cl)N2C(=CC=C2C)C

Other Names for this Substance

  • Benzoic acid, 2-chloro-4-(2,5-dimethyl-1H-pyrrol-1-yl)-
  • 2-Chloro-4-(2,5-dimethyl-1H-pyrrol-1-yl)benzoic acid
  • 2-Chloro-4-(2,5-dimethyl-pyrrol-1-yl)-benzoic acid