1-(2-Bromoethyl)-2-methyl-5-nitroimidazole

CAS Registry Number®

6058-57-7
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CAS Name

1-(2-Bromoethyl)-2-methyl-5-nitroimidazole

Molecular Formula

C6H8BrN3O2

Molecular Mass

234.05

Cite this Page

1-(2-Bromoethyl)-2-methyl-5-nitroimidazole.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=6058-57-7 (retrieved 2024-04-20) (CAS RN: 6058-57-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    81.2 °C

Source(s)

Other Names and Identifiers

InChI

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

InChIKey

InChIKey=HCKPAAMFYJPGMI-UHFFFAOYSA-N

SMILES

C(CBr)N1C(N(=O)=O)=CN=C1C

Canonical SMILES

O=N(=O)C1=CN=C(N1CCBr)C

Other Names for this Substance

  • 1H-Imidazole, 1-(2-bromoethyl)-2-methyl-5-nitro-
  • Imidazole, 1-(2-bromoethyl)-2-methyl-5-nitro-
  • 1-(2-Bromoethyl)-2-methyl-5-nitro-1H-imidazole
  • 1-(2-Bromoethyl)-2-methyl-5-nitroimidazole
  • Br 80

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Deleted or Replaced CAS Registry Numbers

1214889-75-4

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