1-Phenyl-5-propyl-1H-pyrazole-4-carboxylic acid

CAS Registry Number®

116344-17-3

CAS Name

1-Phenyl-5-propyl-1H-pyrazole-4-carboxylic acid

Molecular Formula

C13H14N2O2

Molecular Mass

230.26

Cite this Page

1-Phenyl-5-propyl-1H-pyrazole-4-carboxylic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=116344-17-3 (retrieved 2024-11-24) (CAS RN: 116344-17-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    112 °C

Source(s)

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

Other Names and Identifiers

InChI

InChI=1S/C13H14N2O2/c1-2-6-12-11(13(16)17)9-14-15(12)10-7-4-3-5-8-10/h3-5,7-9H,2,6H2,1H3,(H,16,17)

InChIKey

InChIKey=CBYITWPSSDTYTN-UHFFFAOYSA-N

SMILES

C(CC)C=1N(N=CC1C(O)=O)C2=CC=CC=C2

Canonical SMILES

O=C(O)C=1C=NN(C=2C=CC=CC2)C1CCC

Other Names for this Substance

  • 1H-Pyrazole-4-carboxylic acid, 1-phenyl-5-propyl-
  • 1-Phenyl-5-propyl-1H-pyrazole-4-carboxylic acid
  • 1-Phenyl-5-propylpyrazole-4-carboxylic acid

CAS INSIGHTSTM
Hourglass and a clock