Cas no 93452-43-8 (9-Octadecenoic acid, 2,3-bis[(1-oxohexadecyl)oxy]propyl ester, (9E)-)

9-Octadecenoic acid, 2,3-bis[(1-oxohexadecyl)oxy]propyl ester, (9E)- structure
93452-43-8 structure
Product Name:9-Octadecenoic acid, 2,3-bis[(1-oxohexadecyl)oxy]propyl ester, (9E)-
CAS No:93452-43-8
MF:C53H100O6
MW:833.357518196106
CID:1980584
PubChem ID:6019286
Update Time:2025-04-21

9-Octadecenoic acid, 2,3-bis[(1-oxohexadecyl)oxy]propyl ester, (9E)- Chemical and Physical Properties

Names and Identifiers

    • 9-Octadecenoic acid, 2,3-bis[(1-oxohexadecyl)oxy]propyl ester, (9E)-
    • 1,2-dipalmitoyl-3-oleoyl-rac-glycerol
    • CHEBI:171602
    • 1,2-Dipalmitoyl-3-Elaidoyl-rac-glycerol
    • PD126781
    • HY-157734
    • CS-0997588
    • J-012006
    • 2,3-di(hexadecanoyloxy)propyl (E)-octadec-9-enoate
    • SCHEMBL1395035
    • 1-Oleoyl-2,3-dipalitoylglycerol
    • 37179-82-1
    • a,b-Dipalmitoolein
    • Glycerol 1,2-dihexadecanoate 3-(9Z-octadecenoate)
    • 1,2-Palmitate-3-elaidate
    • 1-Oleoyl-2,3-dipalmitoyl-rac-glycerol
    • 93452-43-8
    • 3-Oleo-1,2-dipalmitin
    • Inchi: 1S/C53H100O6/c1-4-7-10-13-16-19-22-25-26-29-31-34-37-40-43-46-52(55)58-49-50(59-53(56)47-44-41-38-35-32-28-24-21-18-15-12-9-6-3)48-57-51(54)45-42-39-36-33-30-27-23-20-17-14-11-8-5-2/h25-26,50H,4-24,27-49H2,1-3H3/b26-25+
    • InChI Key: YHMDGPZOSGBQRH-OCEACIFDSA-N
    • SMILES: O(C(COC(CCCCCCC/C=C/CCCCCCCC)=O)COC(CCCCCCCCCCCCCCC)=O)C(CCCCCCCCCCCCCCC)=O

Computed Properties

  • Exact Mass: 832.75199091Da
  • Monoisotopic Mass: 832.75199091Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 59
  • Rotatable Bond Count: 51
  • Complexity: 916
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 1
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 22.1
  • Topological Polar Surface Area: 78.9?2

9-Octadecenoic acid, 2,3-bis[(1-oxohexadecyl)oxy]propyl ester, (9E)- Pricemore >>

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