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Substance Name: Imidazole-5-carboxylic acid, 1-benzyl-, methyl ester, hydrochloride
RN: 3157-32-2
InChIKey: PTWSIPBIRSPUSI-UHFFFAOYSA-N

Molecular Formula

  • C12-H12-N2-O2.Cl-H

Molecular Weight

  • 252.6997
 
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Names and Synonyms

Synonym

  • 1-Benzylimidazole-5-carboxylic acid methyl ester hydrochloride

Systematic Name

  • Imidazole-5-carboxylic acid, 1-benzyl-, methyl ester, hydrochloride

Registry Numbers

CAS Registry Number

  • 3157-32-2

System Generated Number

  • 0003157322

Molecular Formulas

Molecular Formula

  • C12-H12-N2-O2.Cl-H

Molecular Formula Fragments

  • C12-H12-N2-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C12H12N2O2.ClH/c1-16-12(15)11-7-13-9-14(11)8-10-5-3-2-4-6-10;/h2-7,9H,8H2,1H3;1H

InChIKey

PTWSIPBIRSPUSI-UHFFFAOYSA-N

Smiles

COC(=O)c1cncn1Cc2ccccc2.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 intravenous 60mg/kg (60mg/kg)   Journal of Medicinal Chemistry. Vol. 8, Pg. 220, 1965.