Cas no 67935-45-9 (1,10-Decanediol, monobenzoate)

1,10-Decanediol, monobenzoate structure
1,10-Decanediol, monobenzoate structure
Product Name:1,10-Decanediol, monobenzoate
CAS No:67935-45-9
MF:C17H26O3
MW:278.386545658112
CID:1722650
Update Time:2024-11-27

1,10-Decanediol, monobenzoate Chemical and Physical Properties

Names and Identifiers

    • 1,10-Decanediol, monobenzoate
    • 1-(benzoyloxy)-10-decanol
    • 1,10-Decanediol, 1-benzoate
    • Inchi: 1S/C17H26O3/c18-14-10-5-3-1-2-4-6-11-15-20-17(19)16-12-8-7-9-13-16/h7-9,12-13,18H,1-6,10-11,14-15H2
    • InChI Key: OIBXQTPGCBMGJG-UHFFFAOYSA-N
    • SMILES: C(OC(=O)C1=CC=CC=C1)CCCCCCCCCO

Computed Properties

  • Exact Mass: 296.19884

Experimental Properties

  • Density: 1.018±0.06 g/cm3(Predicted)
  • Boiling Point: 392.3±15.0 °C(Predicted)
  • PSA: 77.76
  • pka: 15.20±0.10(Predicted)
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