Cas no 228730-30-1 (nonatriacontane-1,39-diol)

nonatriacontane-1,39-diol structure
nonatriacontane-1,39-diol structure
Product Name:nonatriacontane-1,39-diol
CAS No:228730-30-1
MF:C39H80O2
MW:581.051313400269
CID:1412007
Update Time:2024-08-16

nonatriacontane-1,39-diol Chemical and Physical Properties

Names and Identifiers

    • nonatriacontane-1,39-diol
    • 1,39-nonatriacontanediol
    • LogP
    • Inchi: 1S/C39H80O2/c40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2-1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41/h40-41H,1-39H2
    • InChI Key: DBNQZKGGAVLUHZ-UHFFFAOYSA-N
    • SMILES: C(O)CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCO

Computed Properties

  • Exact Mass: 580.6162

Experimental Properties

  • Density: 0.870±0.06 g/cm3(Predicted)
  • Boiling Point: 653.7±28.0 °C(Predicted)
  • PSA: 40.46
  • pka: 14.90±0.10(Predicted)
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