Benzoic acid, 5-methyl-2-(2-pyrimidinyl)-, methyl ester

CAS Registry Number®

1088994-20-0
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CAS Name

Benzoic acid, 5-methyl-2-(2-pyrimidinyl)-, methyl ester

Molecular Formula

C13H12N2O2

Molecular Mass

228.25

Cite this Page

Benzoic acid, 5-methyl-2-(2-pyrimidinyl)-, methyl ester.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=1088994-20-0 (retrieved 2024-05-03) (CAS RN: 1088994-20-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C13H12N2O2/c1-9-4-5-10(11(8-9)13(16)17-2)12-14-6-3-7-15-12/h3-8H,1-2H3

InChIKey

InChIKey=CLMWIPNRUDBNEW-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

O=C(OC)C=1C=C(C=CC1C2=NC=CC=N2)C

Other Names for this Substance

  • Benzoic acid, 5-methyl-2-(2-pyrimidinyl)-, methyl ester
  • Methyl 5-methyl-2-(pyrimidin-2-yl)benzoate

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