1H-Pyrazole-4-carboxylic acid, 3-phenyl-, ethyl ester

CAS Registry Number®

181867-24-3

CAS Name

1H-Pyrazole-4-carboxylic acid, 3-phenyl-, ethyl ester

Molecular Formula

C12H12N2O2

Molecular Mass

216.24

Cite this Page

1H-Pyrazole-4-carboxylic acid, 3-phenyl-, ethyl ester.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=181867-24-3 (retrieved 2024-11-29) (CAS RN: 181867-24-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    112-113 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C12H12N2O2/c1-2-16-12(15)10-8-13-14-11(10)9-6-4-3-5-7-9/h3-8H,2H2,1H3,(H,13,14)

InChIKey

InChIKey=LQIYWOVORITWEA-UHFFFAOYSA-N

SMILES

C(OCC)(=O)C=1C(=NNC1)C2=CC=CC=C2

Canonical SMILES

O=C(OCC)C1=CNN=C1C=2C=CC=CC2

Other Names for this Substance

  • 1H-Pyrazole-4-carboxylic acid, 3-phenyl-, ethyl ester
  • Ethyl 3-phenyl-1H-pyrazole-4-carboxylate
  • NSC 115005

Deleted or Replaced CAS Registry Numbers

861585-88-8

CAS INSIGHTSTM
Hourglass and a clock