Cas no 660390-46-5 (4-Pentacosene-1,3,6-triol, 2-amino-)

4-Pentacosene-1,3,6-triol, 2-amino- structure
660390-46-5 structure
Product Name:4-Pentacosene-1,3,6-triol, 2-amino-
CAS No:660390-46-5
MF:C25H51NO3
MW:413.67734837532
CID:1696249
Update Time:2024-09-02

4-Pentacosene-1,3,6-triol, 2-amino- Chemical and Physical Properties

Names and Identifiers

    • 4-Pentacosene-1,3,6-triol, 2-amino-
    • Inchi: 1S/C25H51NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23(28)20-21-25(29)24(26)22-27/h20-21,23-25,27-29H,2-19,22,26H2,1H3
    • InChI Key: RIWWRPFNZIDPAG-UHFFFAOYSA-N
    • SMILES: C(O)C(N)C(O)C=CC(O)CCCCCCCCCCCCCCCCCCC

Computed Properties

  • Exact Mass: 413.38713

Experimental Properties

  • Density: 0.957±0.06 g/cm3(Predicted)
  • Boiling Point: 571.2±50.0 °C(Predicted)
  • PSA: 86.71
  • pka: 11.85±0.45(Predicted)
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