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Substance Name: 3-Pyrazolecarboxylic acid, 4-amino-5-(p-fluorophenyl)-
RN: 91857-76-0
InChIKey: SSVUWJFOAOMIKB-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C10-H8-F-N3-O2

Molecular Weight

  • 221.1902
 
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Names and Synonyms

Synonyms

  • 1H-Pyrazole-3-carboxylic acid, 4-amino-5-(4-fluorophenyl)-
  • 4-Amino-5-(p-fluorophenyl)-3-pyrazolecarboxylic acid

Systematic Name

  • 3-Pyrazolecarboxylic acid, 4-amino-5-(p-fluorophenyl)-

Registry Numbers

CAS Registry Number

  • 91857-76-0

System Generated Number

  • 0091857760

Structure Descriptors

InChI

1S/C10H8FN3O2/c11-6-3-1-5(2-4-6)8-7(12)9(10(15)16)14-13-8/h1-4H,12H2,(H,13,14)(H,15,16)

InChIKey

SSVUWJFOAOMIKB-UHFFFAOYSA-N

Smiles

Nc1c(n[nH]c1c2ccc(F)cc2)C(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 1gm/kg (1000mg/kg)   Farmaco, Edizione Scientifica. Vol. 39, Pg. 618, 1984.