Cas no 1806-05-9 (5,7-Dibromo-2-(chloromethyl)-1H-benzo[d]imidazole)

5,7-Dibromo-2-(chloromethyl)-1H-benzo[d]imidazole structure
1806-05-9 structure
Product Name:5,7-Dibromo-2-(chloromethyl)-1H-benzo[d]imidazole
CAS No:1806-05-9
MF:C8H5Br2ClN2
MW:324.399698972702
CID:1091039
PubChem ID:11174733
Update Time:2025-04-20

5,7-Dibromo-2-(chloromethyl)-1H-benzo[d]imidazole Chemical and Physical Properties

Names and Identifiers

    • 5,7-Dibromo-2-(chloromethyl)-1H-benzo[d]imidazole
    • 1806-05-9
    • Inchi: 1S/C8H5Br2ClN2/c9-4-1-5(10)8-6(2-4)12-7(3-11)13-8/h1-2H,3H2,(H,12,13)
    • InChI Key: XZFVFGWVVMMZDU-UHFFFAOYSA-N
    • SMILES: BrC1=CC(=CC2=C1N=C(CCl)N2)Br

Computed Properties

  • Exact Mass: 323.84875g/mol
  • Monoisotopic Mass: 321.85080g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 1
  • Complexity: 193
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 3.3
  • Topological Polar Surface Area: 28.7?2
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