5-Nitrobenzimidazole

CAS Registry Number®

94-52-0

CAS Name

5-Nitrobenzimidazole

Molecular Formula

C7H5N3O2

Molecular Mass

163.13

Cite this Page

5-Nitrobenzimidazole.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=94-52-0 (retrieved 2024-11-21) (CAS RN: 94-52-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    203 °C

Source(s)

  • (1) Hazardous Substances Data Bank data were obtained from the National Library of Medicine (US)

Other Names and Identifiers

InChI

InChI=1S/C7H5N3O2/c11-10(12)5-1-2-6-7(3-5)9-4-8-6/h1-4H,(H,8,9)

InChIKey

InChIKey=XPAZGLFMMUODDK-UHFFFAOYSA-N

SMILES

N(=O)(=O)C=1C=C2C(=CC1)N=CN2

Canonical SMILES

O=N(=O)C=1C=CC=2N=CNC2C1

Other Names for this Substance

  • 1H-Benzimidazole, 6-nitro-
  • Benzimidazole, 5-nitro-
  • 1H-Benzimidazole, 5-nitro-
  • Benzimidazole, 5(or 6)-nitro-
  • 6-Nitro-1H-benzimidazole

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Deleted or Replaced CAS Registry Numbers

89843-47-0

CAS INSIGHTSTM
Targeted protein degrader structure, illustration