3-(3,5-Dimethyl-1H-pyrazol-1-yl)-4-methylbenzoic acid

CAS Registry Number®

957514-14-6

CAS Name

3-(3,5-Dimethyl-1H-pyrazol-1-yl)-4-methylbenzoic acid

Molecular Formula

C13H14N2O2

Molecular Mass

230.26

Cite this Page

3-(3,5-Dimethyl-1H-pyrazol-1-yl)-4-methylbenzoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=957514-14-6 (retrieved 2024-11-28) (CAS RN: 957514-14-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C13H14N2O2/c1-8-4-5-11(13(16)17)7-12(8)15-10(3)6-9(2)14-15/h4-7H,1-3H3,(H,16,17)

InChIKey

InChIKey=JKJCWJGBTJPKEQ-UHFFFAOYSA-N

SMILES

CC=1C(=CC(C(O)=O)=CC1)N2C(C)=CC(C)=N2

Canonical SMILES

O=C(O)C1=CC=C(C(=C1)N2N=C(C=C2C)C)C

Other Names for this Substance

  • Benzoic acid, 3-(3,5-dimethyl-1H-pyrazol-1-yl)-4-methyl-
  • 3-(3,5-Dimethyl-1H-pyrazol-1-yl)-4-methylbenzoic acid

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