Cas no 110078-38-1 (1,4,8,11-Tetraazacyclotetradecane,1,1'-(1,2-ethanediyl)bis-)

1,4,8,11-Tetraazacyclotetradecane,1,1'-(1,2-ethanediyl)bis- structure
110078-38-1 structure
Product Name:1,4,8,11-Tetraazacyclotetradecane,1,1'-(1,2-ethanediyl)bis-
CAS No:110078-38-1
MF:C22H50N8
MW:426.686004161835
CID:174766
PubChem ID:453870
Update Time:2025-04-19

1,4,8,11-Tetraazacyclotetradecane,1,1'-(1,2-ethanediyl)bis- Chemical and Physical Properties

Names and Identifiers

    • 1,4,8,11-Tetraazacyclotetradecane,1,1'-(1,2-ethanediyl)bis-
    • N-[2-(propylamino)ethyl]-N'-[2-[2-[2-[3-[2-(propylamino)ethylamino]propylamino]ethylamino]ethylamino]ethyl]propane-1,3-diamine
    • JM2762
    • SCHEMBL674657
    • DTXSID80911488
    • N,N'-Bis(1,4,8,11-tetra-Azatetradecane)ethane
    • 1,2-di(1,4,8,11-tetraazacyclotetradecanyl)ethane
    • N,N'Bicyclamethane
    • 1,4,8,11-Tetraazatetradecane, 1,1'-(1,2-ethanediyl)bis-
    • JM 2762
    • CHEMBL338534
    • 1,1'-(Ethane-1,2-diyl)bis(1,4,8,11-tetraazacyclotetradecane)
    • 1-[2-(1,4,8,11-tetrazacyclotetradec-1-yl)ethyl]-1,4,8,11-tetrazacyclotetradecane
    • 110078-38-1
    • Inchi： 1S/C22H50N8/c1-5-23-11-13-25-9-3-17-29(19-15-27-7-1)21-22-30-18-4-10-26-14-12-24-6-2-8-28-16-20-30/h23-28H,1-22H2
    • InChI Key： GVPVISVGQUQSSG-UHFFFAOYSA-N
    • SMILES： N1(CCNCCCNCCNCCC1)CCN1CCNCCCNCCNCCC1

Computed Properties

  • Exact Mass: 426.4163
  • Monoisotopic Mass: 430.447
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 8
  • Hydrogen Bond Acceptor Count: 8
  • Heavy Atom Count: 30
  • Rotatable Bond Count: 27
  • Complexity: 266
  • 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: 96.2A^2
  • XLogP3: -1.3

Experimental Properties

  • Density: 0.91
  • Boiling Point: 586.9°C at 760 mmHg
  • Flash Point: 318°C
  • Refractive Index: 1.453
  • PSA: 78.66

1,4,8,11-Tetraazacyclotetradecane,1,1'-(1,2-ethanediyl)bis- Related Literature

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