3-(4-Amino-3,5-dimethyl-1H-pyrazol-1-yl)benzoic acid

CAS Registry Number®

1015846-04-4

CAS Name

3-(4-Amino-3,5-dimethyl-1H-pyrazol-1-yl)benzoic acid

Molecular Formula

C12H13N3O2

Molecular Mass

231.25

Cite this Page

3-(4-Amino-3,5-dimethyl-1H-pyrazol-1-yl)benzoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1015846-04-4 (retrieved 2024-12-19) (CAS RN: 1015846-04-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C12H13N3O2/c1-7-11(13)8(2)15(14-7)10-5-3-4-9(6-10)12(16)17/h3-6H,13H2,1-2H3,(H,16,17)

InChIKey

InChIKey=PJFLKWSUDICIDO-UHFFFAOYSA-N

SMILES

CC=1N(N=C(C)C1N)C2=CC(C(O)=O)=CC=C2

Canonical SMILES

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

Other Names for this Substance

  • Benzoic acid, 3-(4-amino-3,5-dimethyl-1H-pyrazol-1-yl)-
  • 3-(4-Amino-3,5-dimethyl-1H-pyrazol-1-yl)benzoic acid

CAS INSIGHTSTM
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