Cas no 37571-28-1 (1,4,7-Triazabicyclo[5.2.2]undecane(9CI))

1,4,7-Triazabicyclo[5.2.2]undecane(9CI) structure
37571-28-1 structure
Product Name:1,4,7-Triazabicyclo[5.2.2]undecane(9CI)
CAS No:37571-28-1
MF:C8H17N3
MW:155.240681409836
CID:320542
PubChem ID:45099402
Update Time:2025-04-19

1,4,7-Triazabicyclo[5.2.2]undecane(9CI) Chemical and Physical Properties

Names and Identifiers

    • 1,4,7-Triazabicyclo[5.2.2]undecane(9CI)
    • Tetraethylenetriamine
    • 1,4,7-Triazabicyclo[5.2.2]undecane
    • 4-CYCLOBUTYLPIPERAZIN-1-AMINE
    • 37571-28-1
    • SCHEMBL12855277
    • DTXSID70667866
    • IYNGLSRZLOHZJA-UHFFFAOYSA-N
    • Inchi: 1S/C8H17N3/c1-3-10-5-7-11(8-6-10)4-2-9-1/h9H,1-8H2
    • InChI Key: IYNGLSRZLOHZJA-UHFFFAOYSA-N
    • SMILES: N12CCNCCN(CC1)CC2

Computed Properties

  • Exact Mass: 155.14241
  • Monoisotopic Mass: 155.142
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 0
  • Complexity: 105
  • 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
  • Topological Polar Surface Area: 18.5A^2
  • XLogP3: -0.6

Experimental Properties

  • Density: 1.074
  • Boiling Point: 247.978 °C at 760 mmHg
  • Flash Point: 118.469 °C
  • PSA: 18.51
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