2-Chloro-4-phenyl-5-pyrimidinecarboxylic acid

CAS Registry Number®

188781-11-5
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CAS Name

2-Chloro-4-phenyl-5-pyrimidinecarboxylic acid

Molecular Formula

C11H7ClN2O2

Molecular Mass

234.64

Cite this Page

2-Chloro-4-phenyl-5-pyrimidinecarboxylic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=188781-11-5 (retrieved 2024-09-11) (CAS RN: 188781-11-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    45-47 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C11H7ClN2O2/c12-11-13-6-8(10(15)16)9(14-11)7-4-2-1-3-5-7/h1-6H,(H,15,16)

InChIKey

InChIKey=KKPIBONOXDAVAE-UHFFFAOYSA-N

SMILES

C(O)(=O)C=1C(=NC(Cl)=NC1)C2=CC=CC=C2

Canonical SMILES

O=C(O)C1=CN=C(Cl)N=C1C=2C=CC=CC2

Other Names for this Substance

  • 5-Pyrimidinecarboxylic acid, 2-chloro-4-phenyl-
  • 2-Chloro-4-phenyl-5-pyrimidinecarboxylic acid