Cas no 102679-72-1 (CHOLESTERYL PALMITELAIDATE)

CHOLESTERYL PALMITELAIDATE structure
CHOLESTERYL PALMITELAIDATE structure
Product Name:CHOLESTERYL PALMITELAIDATE
CAS No:102679-72-1
MF:C43H74O2
MW:623.04647397995
CID:125198
PubChem ID:5879001
Update Time:2024-11-04

CHOLESTERYL PALMITELAIDATE Chemical and Physical Properties

Names and Identifiers

    • CHOLESTERYL PALMITELAIDATE
    • CHOLESTERYL PALMITELAIDATE CRYSTALLINE
    • Cholest-5-en-3β-ol (E)-9-hexadecenoate
    • [10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] (E)-hexadec-9-enoate
    • Cholesteryl palmitelaidate, >=95% (GC)
    • J-000762
    • 102679-72-1
    • DTXSID60421252
    • G90982
    • Inchi: 1S/C43H74O2/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-23-41(44)45-36-28-30-42(5)35(32-36)24-25-37-39-27-26-38(34(4)22-20-21-33(2)3)43(39,6)31-29-40(37)42/h12-13,24,33-34,36-40H,7-11,14-23,25-32H2,1-6H3/b13-12+
    • InChI Key: HODJWNWCVNUPAQ-OUKQBFOZSA-N
    • SMILES: O(C(CCCCCCC/C=C/CCCCCC)=O)C1CCC2(C)C(C1)=CCC1C2CCC2(C)C(C(C)CCCC(C)C)CCC21

Computed Properties

  • Exact Mass: 622.56900
  • Monoisotopic Mass: 622.56888160g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 45
  • Rotatable Bond Count: 20
  • Complexity: 946
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 8
  • Defined Bond Stereocenter Count: 1
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 15.5
  • Topological Polar Surface Area: 26.3?2

Experimental Properties

  • Density: 0.96
  • Boiling Point: 655.3°C at 760 mmHg
  • Flash Point: 350.2°C
  • Refractive Index: 1.511
  • PSA: 26.30000
  • LogP: 13.19690
  • Vapor Pressure: 0.0±2.0 mmHg at 25°C

CHOLESTERYL PALMITELAIDATE Security Information

CHOLESTERYL PALMITELAIDATE Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
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