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Substance Name: 1H-Pyrazole-1-carboxylic acid, 4,5-dihydro-5-phenyl-, sodium salt
RN: 121306-86-3
InChIKey: KFTLNIRJGYOQRK-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C10-H9-N2-O2.Na

Molecular Weight

  • 212.1831
 
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Names and Synonyms

Synonyms

  • Sodium 4,5-dihydro-5-phenyl-1H-pyrazole-1-carboxylate
  • Sodium 5-phenyl-2-pyrazoline-1-carboxylate

Systematic Name

  • 1H-Pyrazole-1-carboxylic acid, 4,5-dihydro-5-phenyl-, sodium salt

Registry Numbers

CAS Registry Number

  • 121306-86-3

System Generated Number

  • 0121306863

Molecular Formulas

Molecular Formula

  • C10-H9-N2-O2.Na

Molecular Formula Fragments

  • C10-H9-N2-O2
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C10H10N2O2.Na/c13-10(14)12-9(6-7-11-12)8-4-2-1-3-5-8;/h1-5,7,9H,6H2,(H,13,14);/q;+1/p-1

InChIKey

KFTLNIRJGYOQRK-UHFFFAOYSA-M

Smiles

c1ccc(cc1)C2CC=NN2C(=O)[O-].[Na+]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 710mg/kg (710mg/kg)   United States Patent Document. Vol. #4990529,