Cas no 97605-97-5 (9-Octadecenoic acid(9Z)-, 3-(2,3-dihydroxypropoxy)-2-hydroxypropyl ester)

9-Octadecenoic acid(9Z)-, 3-(2,3-dihydroxypropoxy)-2-hydroxypropyl ester structure
97605-97-5 structure
Product Name:9-Octadecenoic acid(9Z)-, 3-(2,3-dihydroxypropoxy)-2-hydroxypropyl ester
CAS No:97605-97-5
MF:C24H46O6
MW:430.618448734283
CID:814853
PubChem ID:16206195
Update Time:2025-04-19

9-Octadecenoic acid(9Z)-, 3-(2,3-dihydroxypropoxy)-2-hydroxypropyl ester Chemical and Physical Properties

Names and Identifiers

    • 9-Octadecenoic acid(9Z)-, 3-(2,3-dihydroxypropoxy)-2-hydroxypropyl ester
    • [3-(2,3-dihydroxypropoxy)-2-hydroxypropyl] octadec-9-enoate
    • 3-(2,3-dihydroxypropoxy)-2-hydroxypropyl oleate
    • DTXSID50891364
    • 59029-17-3
    • UNII-5759J47SAM
    • 9-Octadecenoic acid (9Z)-, ester with oxybis[propanediol]
    • Diglyceryl monooleate
    • [3-(2,3-dihydroxypropoxy)-2-hydroxypropyl] (Z)-octadec-9-enoate
    • 9-OCTADECENOIC ACID, MONOESTER WITH OXYBIS(PROPANEDIOL
    • NS00093341
    • 9-Octadecenoic acid, monoester with oxybis(propanediol)
    • 5759J47SAM
    • 9-Octadecenoic acid, ester with 1,2,3-propanetriol
    • Oleic acid, monoester with oxybis(propanediol)
    • 3-(2,3-DIHYDROXYPROPOXY)-2-HYDROXYPROPYL (9Z)-OCTADEC-9-ENOATE
    • EINECS 256-367-4
    • 9-Octadecenoic acid, ester with 1,2,3-propanetriol (1:2)
    • EINECS 307-368-4
    • 49553-76-6
    • 97605-97-5
    • EC 256-367-4
    • Inchi： 1S/C24H46O6/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-24(28)30-21-23(27)20-29-19-22(26)18-25/h9-10,22-23,25-27H,2-8,11-21H2,1H3/b10-9-
    • InChI Key： BKZCZANSHGDPSH-KTKRTIGZSA-N
    • SMILES： O(CC(COCC(CO)O)O)C(CCCCCCC/C=C\CCCCCCCC)=O

Computed Properties

  • Exact Mass: 430.32943918g/mol
  • Monoisotopic Mass: 430.32943918g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 30
  • Rotatable Bond Count: 23
  • Complexity: 399
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 2
  • Defined Bond Stereocenter Count: 1
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 5.5
  • Topological Polar Surface Area: 96.2?2

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