5-Bromo-2-[(4,6-dimethyl-2-pyrimidinyl)amino]benzoic acid

CAS Registry Number®

856437-62-2
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CAS Name

5-Bromo-2-[(4,6-dimethyl-2-pyrimidinyl)amino]benzoic acid

Molecular Formula

C13H12BrN3O2

Molecular Mass

322.16

Cite this Page

5-Bromo-2-[(4,6-dimethyl-2-pyrimidinyl)amino]benzoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=856437-62-2 (retrieved 2024-08-28) (CAS RN: 856437-62-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C13H12BrN3O2/c1-7-5-8(2)16-13(15-7)17-11-4-3-9(14)6-10(11)12(18)19/h3-6H,1-2H3,(H,18,19)(H,15,16,17)

InChIKey

InChIKey=PIHHZGSKJLIUAI-UHFFFAOYSA-N

SMILES

N(C1=C(C(O)=O)C=C(Br)C=C1)C=2N=C(C)C=C(C)N2

Canonical SMILES

O=C(O)C1=CC(Br)=CC=C1NC=2N=C(C=C(N2)C)C

Other Names for this Substance

  • Benzoic acid, 5-bromo-2-[(4,6-dimethyl-2-pyrimidinyl)amino]-
  • 5-Bromo-2-[(4,6-dimethyl-2-pyrimidinyl)amino]benzoic acid