3-(2-Pyrimidinylmethyl)benzoic acid

CAS Registry Number®

562803-69-4
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CAS Name

3-(2-Pyrimidinylmethyl)benzoic acid

Molecular Formula

C12H10N2O2

Molecular Mass

214.22

Cite this Page

3-(2-Pyrimidinylmethyl)benzoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=562803-69-4 (retrieved 2024-08-07) (CAS RN: 562803-69-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C12H10N2O2/c15-12(16)10-4-1-3-9(7-10)8-11-13-5-2-6-14-11/h1-7H,8H2,(H,15,16)

InChIKey

InChIKey=CZXRPFHLIMKLEM-UHFFFAOYSA-N

SMILES

C(C1=CC(C(O)=O)=CC=C1)C=2N=CC=CN2

Canonical SMILES

O=C(O)C1=CC=CC(=C1)CC2=NC=CC=N2

Other Names for this Substance

  • Benzoic acid, 3-(2-pyrimidinylmethyl)-
  • 3-(2-Pyrimidinylmethyl)benzoic acid