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Substance Name: Imidazole-5-carboxylic acid, 1-(p-fluoro-alpha-methylbenzyl)-, methyl ester, hydrochloride, DL-
RN: 7127-01-7
InChIKey: ZBSGROCEYPIZGB-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H13-F-N2-O2.Cl-H

Molecular Weight

  • 284.7166
 
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Names and Synonyms

Synonym

  • DL-1-(p-Fluoro-1-phenethyl)imidazole-5-carboxylic acid methyl ester hydrochloride

Systematic Name

  • Imidazole-5-carboxylic acid, 1-(p-fluoro-alpha-methylbenzyl)-, methyl ester, hydrochloride, DL-

Registry Numbers

CAS Registry Number

  • 7127-01-7

System Generated Number

  • 0007127017

Molecular Formulas

Molecular Formula

  • C13-H13-F-N2-O2.Cl-H

Molecular Formula Fragments

  • C13-H13-F-N2-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C13H13FN2O2.ClH/c1-9(10-3-5-11(14)6-4-10)16-8-15-7-12(16)13(17)18-2;/h3-9H,1-2H3;1H

InChIKey

ZBSGROCEYPIZGB-UHFFFAOYSA-N

Smiles

CC(c1ccc(cc1)F)n2cncc2C(=O)OC.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 intravenous 38mg/kg (38mg/kg)   Journal of Medicinal Chemistry. Vol. 8, Pg. 220, 1965.