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Substance Name: 1-(2-Chloroethyl)-2-methyl-5-nitroimidazole
RN: 13182-81-5
UNII: 8A2R934D6A
InChIKey: FSFWMJBQLWFXSM-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C6-H8-Cl-N3-O2

Molecular Weight

  • 189.6012
 
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Names and Synonyms

Name of Substance

  • 1-(2-Chloroethyl)-2-methyl-5-nitroimidazole

Synonyms

  • 1-(2-Chloroethyl)-2-methyl-5-nitroimidazole
  • 5-23-05-00059 (Beilstein Handbook Reference)
  • BRN 0611685
  • UNII-8A2R934D6A

Systematic Name

  • Imidazole, 1-(2-chloroethyl)-2-methyl-5-nitro-

Registry Numbers

CAS Registry Number

  • 13182-81-5

FDA UNII

  • 8A2R934D6A

System Generated Number

  • 0013182815

Structure Descriptors

InChI

1S/C6H8ClN3O2/c1-5-8-4-6(10(11)12)9(5)3-2-7/h4H,2-3H2,1H3

InChIKey

FSFWMJBQLWFXSM-UHFFFAOYSA-N

Smiles

Cc1ncc(n1CCCl)[N+](=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. 11, Pg. 167, 1968.