1-Methyl-4-nitro-1H-imidazole-5-carbonitrile

CAS Registry Number®

40648-96-2
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CAS Name

1-Methyl-4-nitro-1H-imidazole-5-carbonitrile

Molecular Formula

C5H4N4O2

Molecular Mass

152.11

Cite this Page

1-Methyl-4-nitro-1H-imidazole-5-carbonitrile.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=40648-96-2 (retrieved 2024-09-13) (CAS RN: 40648-96-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    141-142 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C5H4N4O2/c1-8-3-7-5(9(10)11)4(8)2-6/h3H,1H3

InChIKey

InChIKey=LXXDMPXVEZYDCI-UHFFFAOYSA-N

SMILES

C(#N)C1=C(N(=O)=O)N=CN1C

Canonical SMILES

N#CC1=C(N=CN1C)N(=O)=O

Other Names for this Substance

  • 1H-Imidazole-5-carbonitrile, 1-methyl-4-nitro-
  • Imidazole-5-carbonitrile, 1-methyl-4-nitro-
  • 1-Methyl-4-nitro-1H-imidazole-5-carbonitrile
  • 1-Methyl-4-nitroimidazole-5-carbonitrile
  • 5-Cyano-1-methyl-4-nitroimidazole

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