Cas no 38096-68-3 (bis[2-(2-hydroxyethoxy)ethyl]-methyl-nonadecyl-azanium)

bis[2-(2-hydroxyethoxy)ethyl]-methyl-nonadecyl-azanium structure
38096-68-3 structure
Product Name:bis[2-(2-hydroxyethoxy)ethyl]-methyl-nonadecyl-azanium
CAS No:38096-68-3
MF:C28H60NO4
MW:474.780309677124
CID:311978
PubChem ID:169997
Update Time:2025-04-19

bis[2-(2-hydroxyethoxy)ethyl]-methyl-nonadecyl-azanium Chemical and Physical Properties

Names and Identifiers

    • bis[2-(2-hydroxyethoxy)ethyl]-methyl-nonadecyl-azanium
    • bis[2-(2-hydroxyethoxy)ethyl]-methyl-nonadecylazanium
    • n,n-bis[2-(2-hydroxyethoxy)ethyl]-n-methylnonadecan-1-aminium
    • DTXSID60865899
    • 38096-68-3
    • Inchi: 1S/C28H60NO4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-29(2,21-25-32-27-23-30)22-26-33-28-24-31/h30-31H,3-28H2,1-2H3/q+1
    • InChI Key: WHMXSKOOSSXRQQ-UHFFFAOYSA-N
    • SMILES: O(CCO)CC[N+](C)(CCOCCO)CCCCCCCCCCCCCCCCCCC

Computed Properties

  • Exact Mass: 474.4525
  • Monoisotopic Mass: 474.452
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 33
  • Rotatable Bond Count: 28
  • Complexity: 356
  • 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: 8
  • Topological Polar Surface Area: 58.9?2

Experimental Properties

  • Boiling Point: °Cat760mmHg
  • Flash Point: °C
  • PSA: 58.92
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