Cas no 771580-57-5 (5-(aminomethyl)-1h-imidazol-4-amine)

5-(aminomethyl)-1h-imidazol-4-amine structure
771580-57-5 structure
Product Name:5-(aminomethyl)-1h-imidazol-4-amine
CAS No:771580-57-5
MF:C4H8N4
MW:112.13311958313
CID:1783406
PubChem ID:53423910
Update Time:2025-04-21

5-(aminomethyl)-1h-imidazol-4-amine Chemical and Physical Properties

Names and Identifiers

    • 5-(aminomethyl)-1h-imidazol-4-amine
    • AKOS006294055
    • 771580-57-5
    • DTXSID50698411
    • 5-AMINOMETHYL-1H-IMIDAZOL-4-AMINE
    • Inchi: 1S/C4H8N4/c5-1-3-4(6)8-2-7-3/h2H,1,5-6H2,(H,7,8)
    • InChI Key: YVJZPFHJIPJTDQ-UHFFFAOYSA-N
    • SMILES: N1C=NC(=C1CN)N

Computed Properties

  • Exact Mass: 112.074896272g/mol
  • Monoisotopic Mass: 112.074896272g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 8
  • Rotatable Bond Count: 1
  • Complexity: 74.4
  • 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: -0.8
  • Topological Polar Surface Area: 80.7?2
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