Cas no 69926-30-3 (4-Nitro-1H-benzimidazole)

4-Nitro-1H-benzimidazole structure
4-Nitro-1H-benzimidazole structure
Product Name:4-Nitro-1H-benzimidazole
CAS No:69926-30-3
MF:C7H5N3O2
MW:163.133500814438
CID:853176
Update Time:2023-08-02

4-Nitro-1H-benzimidazole Chemical and Physical Properties

Names and Identifiers

    • 1H-Benzimidazole,7-nitro-(9CI)
    • 4-Nitrobenzimidazole
    • 7-nitro-1H-benzo[d]imidazole
    • 4-Nitro-1H-benzimidazole
    • 1H-Benzimidazole, 4-nitro-
    • Benzimidazole, 4-nitro-
    • 4(7)-Nitrobenzimidazole
    • 4-nitro-1H-benzo[d]imidazole
    • 1H-Benzimidazole,7-nitro-
    • NEJMFSBXFBFELK-UHFFFAOYSA-N
    • 4-Nitro-1H-benzoimidazole
    • 4-nitro-1H-1,3-benzodiazole
    • 7-nitrobenzimidazole
    • 4-nitro-benzimidazole
    • Oprea1_779086
    • 1H-Benzimidazole, 7-nitro-
    • Benzimidazole, 4(or 7)-nitro-
    • FCH917040
    • BDBM50
    • Inchi: 1S/C7H5N3O2/c11-10(12)6-3-1-2-5-7(6)9-4-8-5/h1-4H,(H,8,9)
    • InChI Key: NEJMFSBXFBFELK-UHFFFAOYSA-N
    • SMILES: [O-][N+](C1=CC=CC2=C1N=CN2)=O

Computed Properties

  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 0
  • Complexity: 192
  • Topological Polar Surface Area: 74.5
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