Cas no 860382-50-9 (1,2,3-Propanetriamine,N1-(2,3-diaminopropyl)-)

1,2,3-Propanetriamine,N1-(2,3-diaminopropyl)- structure
860382-50-9 structure
Product Name:1,2,3-Propanetriamine,N1-(2,3-diaminopropyl)-
CAS No:860382-50-9
MF:C6H19N5
MW:161.248560190201
CID:718161
PubChem ID:88766362
Update Time:2025-04-19

1,2,3-Propanetriamine,N1-(2,3-diaminopropyl)- Chemical and Physical Properties

Names and Identifiers

    • 1,2,3-Propanetriamine,N1-(2,3-diaminopropyl)-
    • Diethylenetriamine, 2,6-bis(aminomethyl)- (6CI)
    • 860382-50-9
    • N1-(2,3-Diaminopropyl)propane-1,2,3-triamine
    • Inchi: 1S/C6H19N5/c7-1-5(9)3-11-4-6(10)2-8/h5-6,11H,1-4,7-10H2
    • InChI Key: BKLGOOWBBNKITK-UHFFFAOYSA-N
    • SMILES: N(CC(CN)N)CC(CN)N

Computed Properties

  • Exact Mass: 161.16404563g/mol
  • Monoisotopic Mass: 161.16404563g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 5
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 6
  • Complexity: 77
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 2
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: -3.8
  • Topological Polar Surface Area: 116?2
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