Cas no 660437-65-0 (Glutamic acid, 5-octadecyl ester)

Glutamic acid, 5-octadecyl ester structure
660437-65-0 structure
Product Name:Glutamic acid, 5-octadecyl ester
CAS No:660437-65-0
MF:C23H44NO4
MW:398.599767684937
CID:1700970
PubChem ID:71375250
Update Time:2025-04-21

Glutamic acid, 5-octadecyl ester Chemical and Physical Properties

Names and Identifiers

    • Glutamic acid, 5-octadecyl ester
    • (4S)-4-amino-5-octadecan-5-yloxy-5-oxopentanoate
    • 660437-65-0
    • 5-[(5-Oxidanidyl-5-oxidanylidene-L-norvalyl)oxy]octadecane
    • DTXSID50797998
    • Inchi: 1S/C23H45NO4/c1-3-5-7-8-9-10-11-12-13-14-15-17-20(16-6-4-2)28-23(27)21(24)18-19-22(25)26/h20-21H,3-19,24H2,1-2H3,(H,25,26)/p-1/t20?,21-/m0/s1
    • InChI Key: HVFXZIGREPBGND-LBAQZLPGSA-M
    • SMILES: O(C([C@H](CCC(=O)[O-])N)=O)C(CCCC)CCCCCCCCCCCCC

Computed Properties

  • Exact Mass: 398.32722
  • Monoisotopic Mass: 398.32703388g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 28
  • Rotatable Bond Count: 20
  • Complexity: 381
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 1
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 6
  • Topological Polar Surface Area: 92.4?2

Experimental Properties

  • PSA: 92.45
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