2-[(2-Chloro-6-methyl-4-pyrimidinyl)amino]benzoic acid

CAS Registry Number®

31185-81-6

CAS Name

2-[(2-Chloro-6-methyl-4-pyrimidinyl)amino]benzoic acid

Molecular Formula

C12H10ClN3O2

Molecular Mass

263.68

Cite this Page

2-[(2-Chloro-6-methyl-4-pyrimidinyl)amino]benzoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=31185-81-6 (retrieved 2024-11-29) (CAS RN: 31185-81-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    >290 °C

Source(s)

  • (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.

Other Names and Identifiers

InChI

InChI=1S/C12H10ClN3O2/c1-7-6-10(16-12(13)14-7)15-9-5-3-2-4-8(9)11(17)18/h2-6H,1H3,(H,17,18)(H,14,15,16)

InChIKey

InChIKey=SHUJWBBQJVFGDE-UHFFFAOYSA-N

SMILES

N(C1=C(C(O)=O)C=CC=C1)C=2C=C(C)N=C(Cl)N2

Canonical SMILES

O=C(O)C=1C=CC=CC1NC2=NC(Cl)=NC(=C2)C

Other Names for this Substance

  • Benzoic acid, 2-[(2-chloro-6-methyl-4-pyrimidinyl)amino]-
  • Anthranilic acid, N-(2-chloro-6-methyl-4-pyrimidinyl)-
  • 2-[(2-Chloro-6-methyl-4-pyrimidinyl)amino]benzoic acid
  • 2-((2-Chloro-6-methylpyrimidin-4(3H)-ylidene)amino)benzoic acid

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