Cas no 54563-85-8 (Tetracosanoic acid, 2-hydroxy-, methyl ester, (R)-)

Tetracosanoic acid, 2-hydroxy-, methyl ester, (R)- structure
54563-85-8 structure
Product Name:Tetracosanoic acid, 2-hydroxy-, methyl ester, (R)-
CAS No:54563-85-8
MF:C25H50O3
MW:398.662708759308
CID:354236
PubChem ID:13942508
Update Time:2025-04-19

Tetracosanoic acid, 2-hydroxy-, methyl ester, (R)- Chemical and Physical Properties

Names and Identifiers

    • Tetracosanoic acid, 2-hydroxy-, methyl ester, (R)-
    • Methyl (2R)-2-hydroxytetracosanoate
    • DTXSID80552971
    • 54563-85-8
    • (2r)-2-hydroxy-lignoceric acid methyl ester
    • Inchi: 1S/C25H50O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24(26)25(27)28-2/h24,26H,3-23H2,1-2H3/t24-/m1/s1
    • InChI Key: MSVLAXSCPVNLFM-XMMPIXPASA-N
    • SMILES: O[C@@H](C(=O)OC)CCCCCCCCCCCCCCCCCCCCCC

Computed Properties

  • Exact Mass: 398.3762
  • Monoisotopic Mass: 398.37599545g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 28
  • Rotatable Bond Count: 23
  • Complexity: 317
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 1
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 11
  • Topological Polar Surface Area: 46.5?2

Experimental Properties

  • PSA: 46.53
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