Cas no 93882-73-6 (Tetradecyl hydrogen 2-octadecenylsuccinate)

Tetradecyl hydrogen 2-octadecenylsuccinate structure
93882-73-6 structure
Product Name:Tetradecyl hydrogen 2-octadecenylsuccinate
CAS No:93882-73-6
MF:C36H68O4
MW:564.92273235321
CID:807660
PubChem ID:44144690
Update Time:2025-04-19

Tetradecyl hydrogen 2-octadecenylsuccinate Chemical and Physical Properties

Names and Identifiers

    • Tetradecyl hydrogen 2-octadecenylsuccinate
    • EINECS 299-457-9
    • 93882-73-6
    • Inchi: 1S/C36H68O4/c1-3-5-7-9-11-13-15-17-18-19-20-21-23-25-27-29-31-34(36(38)39)33-35(37)40-32-30-28-26-24-22-16-14-12-10-8-6-4-2/h27,29,34H,3-26,28,30-33H2,1-2H3,(H,38,39)/b29-27+
    • InChI Key: SKYLQULFFWHTRS-ORIPQNMZSA-N
    • SMILES: O(C(CC(C(=O)O)C/C=C/CCCCCCCCCCCCCCC)=O)CCCCCCCCCCCCCC

Computed Properties

  • Exact Mass: 564.512
  • Monoisotopic Mass: 564.512
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 40
  • Rotatable Bond Count: 33
  • Complexity: 571
  • 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
  • Topological Polar Surface Area: 63.6A^2
  • XLogP3: 15.1

Experimental Properties

  • Boiling Point: 635.9°Cat760mmHg
  • Flash Point: 179.9°C

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