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Substance Name: Imidazole, 1-(2-bromoethyl)-2-methyl-4-nitro-
RN: 18504-27-3
InChIKey: CSQXNWZCQFPOFB-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C6-H8-Br-N3-O2

Molecular Weight

  • 234.052
 
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Names and Synonyms

Synonyms

  • 1-(2-Bromoethyl)-2-methyl-4-nitroimidazole
  • 5-23-05-00077 (Beilstein Handbook Reference)
  • BRN 0610470

Systematic Name

  • Imidazole, 1-(2-bromoethyl)-2-methyl-4-nitro-

Registry Numbers

CAS Registry Number

  • 18504-27-3

System Generated Number

  • 0018504273

Structure Descriptors

InChI

1S/C6H8BrN3O2/c1-5-8-6(10(11)12)4-9(5)3-2-7/h4H,2-3H2,1H3

InChIKey

CSQXNWZCQFPOFB-UHFFFAOYSA-N

Smiles

c1(nc(C)n(c1)CCBr)[N+]([O-])=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 350mg/kg (350mg/kg)   Journal of Medicinal Chemistry. Vol. 11, Pg. 167, 1968.