Cas no 37673-41-9 (hexacosyl 5-oxo-L-prolinate)

hexacosyl 5-oxo-L-prolinate structure
hexacosyl 5-oxo-L-prolinate structure
Product Name:hexacosyl 5-oxo-L-prolinate
CAS No:37673-41-9
MF:C31H59NO3
MW:493.805070161819
CID:922492
PubChem ID:56842486
Update Time:2025-04-19

hexacosyl 5-oxo-L-prolinate Chemical and Physical Properties

Names and Identifiers

    • hexacosyl 5-oxo-L-prolinate
    • hexacosyl (2S)-5-oxopyrrolidine-2-carboxylate
    • 37673-41-9
    • ICAHUYHJMWQWCZ-LJAQVGFWSA-N
    • EINECS 253-609-0
    • NS00030256
    • DTXSID60191105
    • Inchi: 1S/C31H59NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-28-35-31(34)29-26-27-30(33)32-29/h29H,2-28H2,1H3,(H,32,33)/t29-/m0/s1
    • InChI Key: ICAHUYHJMWQWCZ-LJAQVGFWSA-N
    • SMILES: O(C([C@@H]1CCC(N1)=O)=O)CCCCCCCCCCCCCCCCCCCCCCCCCC

Computed Properties

  • Exact Mass: 493.44977
  • Monoisotopic Mass: 493.44949474g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 35
  • Rotatable Bond Count: 27
  • Complexity: 494
  • 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: 12.7
  • Topological Polar Surface Area: 55.4?2

Experimental Properties

  • PSA: 55.4
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