ChemSpider 2D Image | 16-(Benzyloxy)-16-oxohexadecanoic acid | C23H36O4

16-(Benzyloxy)-16-oxohexadecanoic acid

  • Molecular FormulaC23H36O4
  • Average mass376.530 Da
  • Monoisotopic mass376.261353 Da
  • ChemSpider ID57423223

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

16-(Benzyloxy)-16-oxohexadecanoic acid [ACD/IUPAC Name]
16-(Benzyloxy)-16-oxohexadecansäure [German] [ACD/IUPAC Name]
Acide 16-(benzyloxy)-16-oxohexadécanoïque [French] [ACD/IUPAC Name]
Hexadecanedioic acid, mono(phenylmethyl) ester [ACD/Index Name]
146004-98-0 [RN]
16-(benzyloxy)-16-oxohexadecanoic acid(wxc02567)
16-oxo-16-phenylmethoxyhexadecanoic acid
MFCD29917032

    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.0±0.1 g/cm3
    Boiling Point: 505.8±23.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.4 mmHg at 25°C
    Enthalpy of Vaporization: 81.7±3.0 kJ/mol
    Flash Point: 164.0±16.1 °C
    Index of Refraction: 1.502
    Molar Refractivity: 108.6±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 1
    #Freely Rotating Bonds: 18
    #Rule of 5 Violations: 1
    ACD/LogP: 7.26
    ACD/LogD (pH 5.5): 5.68
    ACD/BCF (pH 5.5): 7921.12
    ACD/KOC (pH 5.5): 12766.36
    ACD/LogD (pH 7.4): 3.89
    ACD/BCF (pH 7.4): 127.07
    ACD/KOC (pH 7.4): 204.80
    Polar Surface Area: 64 Å2
    Polarizability: 43.1±0.5 10-24cm3
    Surface Tension: 40.3±3.0 dyne/cm
    Molar Volume: 368.0±3.0 cm3

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