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Substance Name: Imidazole-5-carboxylic acid, 1-(alpha-ethylbenzyl)-, methyl ester, hydrochloride, DL-
RN: 7126-99-0
InChIKey: NBAVCXTUQICNDF-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H16-N2-O.Cl-H

Molecular Weight

  • 280.7533
 
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Names and Synonyms

Synonym

  • DL-1-(alpha-Ethylbenzyl)imidazole-5-carboxylic acid methyl ester hydrochloride

Systematic Name

  • Imidazole-5-carboxylic acid, 1-(alpha-ethylbenzyl)-, methyl ester, hydrochloride, DL-

Registry Numbers

CAS Registry Number

  • 7126-99-0

System Generated Number

  • 0007126990

Molecular Formulas

Molecular Formula

  • C14-H16-N2-O.Cl-H

Molecular Formula Fragments

  • C14-H16-N2-O
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C14H16N2O2.ClH/c1-3-12(11-7-5-4-6-8-11)16-10-15-9-13(16)14(17)18-2;/h4-10,12H,3H2,1-2H3;1H

InChIKey

NBAVCXTUQICNDF-UHFFFAOYSA-N

Smiles

CCC(c1ccccc1)n2cncc2C(=O)OC.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 intravenous 57mg/kg (57mg/kg)   Journal of Medicinal Chemistry. Vol. 8, Pg. 220, 1965.