Cas no 62745-98-6 (2-Hexadecanol, 1-[(6-aminohexyl)amino]-)

2-Hexadecanol, 1-[(6-aminohexyl)amino]- structure
62745-98-6 structure
Product Name:2-Hexadecanol, 1-[(6-aminohexyl)amino]-
CAS No:62745-98-6
MF:C22H48N2O
MW:356.629326820374
CID:433427
PubChem ID:71383256
Update Time:2025-04-19

2-Hexadecanol, 1-[(6-aminohexyl)amino]- Chemical and Physical Properties

Names and Identifiers

    • 2-Hexadecanol, 1-[(6-aminohexyl)amino]-
    • 1-(6-aminohexylamino)hexadecan-2-ol
    • 62745-98-6
    • 1-[(6-AMINOHEXYL)AMINO]HEXADECAN-2-OL
    • DTXSID80805590
    • Inchi: 1S/C22H48N2O/c1-2-3-4-5-6-7-8-9-10-11-12-15-18-22(25)21-24-20-17-14-13-16-19-23/h22,24-25H,2-21,23H2,1H3
    • InChI Key: IZJJZANQSUFHQD-UHFFFAOYSA-N
    • SMILES: OC(CNCCCCCCN)CCCCCCCCCCCCCC

Computed Properties

  • Exact Mass: 356.37694
  • Monoisotopic Mass: 356.376664159g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 25
  • Rotatable Bond Count: 21
  • Complexity: 236
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 6.9
  • Topological Polar Surface Area: 58.3?2

Experimental Properties

  • PSA: 58.28
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