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Substance Name: Imidazole-1-acetic acid, 5-methyl-2-nitro-
RN: 23571-51-9
InChIKey: XTWAAJAXJLPIMX-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C6-H7-N3-O4

Molecular Weight

  • 185.1383
 
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Names and Synonyms

Synonym

  • 5-Methyl-2-nitroimidazole-1-acetic acid

Systematic Name

  • Imidazole-1-acetic acid, 5-methyl-2-nitro-

Registry Numbers

CAS Registry Number

  • 23571-51-9

System Generated Number

  • 0023571519

Structure Descriptors

InChI

1S/C6H7N3O4/c1-4-2-7-6(9(12)13)8(4)3-5(10)11/h2H,3H2,1H3,(H,10,11)

InChIKey

XTWAAJAXJLPIMX-UHFFFAOYSA-N

Smiles

Cc1cnc([N+](=O)[O-])n1CC(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 1gm/kg (1000mg/kg)   Journal of Medicinal Chemistry. Vol. 12, Pg. 775, 1969.