Cas no 6952-63-2 (9-Octadecenamide, N-octadecyl-, (Z)-)

9-Octadecenamide, N-octadecyl-, (Z)- structure
6952-63-2 structure
Product Name:9-Octadecenamide, N-octadecyl-, (Z)-
CAS No:6952-63-2
MF:C36H71NO
MW:533.955051660538
CID:525378
PubChem ID:5355912
Update Time:2025-04-19

9-Octadecenamide, N-octadecyl-, (Z)- Chemical and Physical Properties

Names and Identifiers

    • 9-Octadecenamide, N-octadecyl-, (Z)-
    • (Z)-N-octadecyl-9-octadecenamide
    • Oleamide, N-octadecyl-
    • 9-Octadecenamide, N-octadecyl-, (9Z)-
    • Einecs 230-128-4
    • N-octadecyl oleic amide
    • N-Octadecyl-oleamid
    • N-octadecyloleamide
    • N-octadecyl-oleamide
    • N-stearyl oleamide
    • Oelsaeure-octadecylamid
    • Stearyl oleamide
    • 6952-63-2
    • NS00044384
    • NSC 46993
    • (9Z)-N-Octadecyl-9-octadecenamide
    • DTXSID001299044
    • SCHEMBL428311
    • Inchi: 1S/C36H71NO/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-36(38)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h18,20H,3-17,19,21-35H2,1-2H3,(H,37,38)/b20-18-
    • InChI Key: VZGOTNLOZGRSJA-ZZEZOPTASA-N
    • SMILES: O=C(CCCCCCC/C=C\CCCCCCCC)NCCCCCCCCCCCCCCCCCC

Computed Properties

  • Exact Mass: 533.55393
  • Monoisotopic Mass: 533.55356589g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 38
  • Rotatable Bond Count: 32
  • Complexity: 472
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 1
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 15.9
  • Topological Polar Surface Area: 29.1?2

Experimental Properties

  • PSA: 29.1
  • LogP: 12.79250
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