Cas no 107649-74-1 (Octadecanoic acid, 3-hydroxy-2-[(1-oxo-9-octadecenyl)amino]-, methylester)

Octadecanoic acid, 3-hydroxy-2-[(1-oxo-9-octadecenyl)amino]-, methylester structure
107649-74-1 structure
Product Name:Octadecanoic acid, 3-hydroxy-2-[(1-oxo-9-octadecenyl)amino]-, methylester
CAS No:107649-74-1
MF:C37H71NO4
MW:593.963952302933
CID:1189620
Update Time:2024-08-05

Octadecanoic acid, 3-hydroxy-2-[(1-oxo-9-octadecenyl)amino]-, methylester Chemical and Physical Properties

Names and Identifiers

    • Octadecanoic acid, 3-hydroxy-2-[(1-oxo-9-octadecenyl)amino]-, methylester
    • Octadecanoic acid, 3-hydroxy-2-[(1-oxo-9-octadecen-1-yl)amino]-, methyl ester
    • Inchi: 1S/C37H71NO4/c1-4-6-8-10-12-14-16-18-19-21-23-25-27-29-31-33-35(40)38-36(37(41)42-3)34(39)32-30-28-26-24-22-20-17-15-13-11-9-7-5-2/h18-19,34,36,39H,4-17,20-33H2,1-3H3,(H,38,40)
    • InChI Key: MFQGIWGSFANCFN-UHFFFAOYSA-N
    • SMILES: C(OC)(=O)C(NC(=O)CCCCCCCC=CCCCCCCCC)C(O)CCCCCCCCCCCCCCC

Computed Properties

  • Exact Mass: 593.53863

Experimental Properties

  • Density: 0.927±0.06 g/cm3(Predicted)
  • Boiling Point: 695.6±50.0 °C(Predicted)
  • PSA: 75.63
  • pka: 13.89±0.20(Predicted)
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