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Substance Name: Imidazole-5-carboxylic acid, 1-benzyl-, methyl ester
RN: 73941-33-0
InChIKey: DOTNQIPIURWNFJ-UHFFFAOYSA-N

Molecular Formula

  • C12-H12-N2-O2

Molecular Weight

  • 216.2388
 
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Names and Synonyms

Synonyms

  • 1-Benzyl-5-imidazolecarboxylic acid methyl ester
  • 4-25-00-00724 (Beilstein Handbook Reference)
  • BRN 0199825
  • EINECS 277-646-7
  • Imidazole-5-carboxylic acid, 1-benzyl-, methyl ester
  • Methyl 1-benzylimidazole-5-carboxylate
  • NSC 91543

Systematic Names

  • 1H-Imidazole-5-carboxylic acid, 1-(phenylmethyl)-, methyl ester (9CI)
  • Imidazole-5-carboxylic acid, 1-benzyl-, methyl ester
  • Methyl 1-benzyl-1H-imidazole-5-carboxylate

Registry Numbers

CAS Registry Number

  • 73941-33-0

System Generated Number

  • 0073941330

Structure Descriptors

InChI

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

InChIKey

DOTNQIPIURWNFJ-UHFFFAOYSA-N

Smiles

COC(=O)c1cncn1Cc2ccccc2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 100mg/kg (100mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#03030,