Cas no 26149-52-0 (D-Glucitol,1,4:3,6-dianhydro-, dioctadecanoate (9CI))

D-Glucitol,1,4:3,6-dianhydro-, dioctadecanoate (9CI) structure
26149-52-0 structure
Product Name:D-Glucitol,1,4:3,6-dianhydro-, dioctadecanoate (9CI)
CAS No:26149-52-0
MF:C42H78O6
MW:679.065134525299
CID:282868
PubChem ID:117298
Update Time:2025-04-19

D-Glucitol,1,4:3,6-dianhydro-, dioctadecanoate (9CI) Chemical and Physical Properties

Names and Identifiers

    • D-Glucitol,1,4:3,6-dianhydro-, dioctadecanoate (9CI)
    • 1,4:3,6-dianhydro-2,5-di-O-octadecanoylhexitol
    • 1,4:3,6-Dianhydro-D-glucitol distearate
    • EINECS 247-478-9
    • 26149-52-0
    • DTXSID60949027
    • Inchi: 1S/C42H78O6/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-39(43)47-37-35-45-42-38(36-46-41(37)42)48-40(44)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h37-38,41-42H,3-36H2,1-2H3
    • InChI Key: DBYUDQKISNUIGB-UHFFFAOYSA-N
    • SMILES: O1CC(C2C1C(CO2)OC(CCCCCCCCCCCCCCCCC)=O)OC(CCCCCCCCCCCCCCCCC)=O

Computed Properties

  • Exact Mass: 678.58
  • Monoisotopic Mass: 678.58
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 48
  • Rotatable Bond Count: 36
  • Complexity: 694
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 4
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 71.1A^2
  • XLogP3: 16.3

Experimental Properties

  • Density: 0.97
  • Boiling Point: 696.5°Cat760mmHg
  • Flash Point: 273.5°C
  • Refractive Index: 1.486
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