ChemSpider 2D Image | O~15~-Palmitoyl(4,4,18,18,18-~2~H_5_)retinol | C36H55D5O2

O15-Palmitoyl(4,4,18,18,18-2H5)retinol

  • Molecular FormulaC36H55D5O2
  • Average mass529.891 Da
  • Monoisotopic mass529.490723 Da
  • ChemSpider ID48063476

  • Double-bond stereo - Double-bond stereo

    Non-standard isotope - Non-standard isotope

More details:

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

O15-Palmitoyl(4,4,18,18,18-2H5)retinol [German] [ACD/IUPAC Name]
O15-Palmitoyl(4,4,18,18,18-2H5)retinol [ACD/IUPAC Name]
O15-Palmitoyl(4,4,18,18,18-2H5)rétinol [French] [ACD/IUPAC Name]
Retinol-4,4,18,18,18-d5, O15-(1-oxohexadecyl)- [ACD/Index Name]
1331666-45-5 [RN]
9-cis-retinyl palmitate-d5

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

    Density: 0.9±0.1 g/cm3
    Boiling Point: 607.5±24.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.7 mmHg at 25°C
    Enthalpy of Vaporization: 90.3±3.0 kJ/mol
    Flash Point: 79.7±21.2 °C
    Index of Refraction: 1.508
    Molar Refractivity: 169.9±0.3 cm3
    #H bond acceptors: 2
    #H bond donors: 0
    #Freely Rotating Bonds: 21
    #Rule of 5 Violations: 2
    ACD/LogP: 14.83
    ACD/LogD (pH 5.5): 13.75
    ACD/BCF (pH 5.5): 1000000.00
    ACD/KOC (pH 5.5): 10000000.00
    ACD/LogD (pH 7.4): 13.75
    ACD/BCF (pH 7.4): 1000000.00
    ACD/KOC (pH 7.4): 10000000.00
    Polar Surface Area: 26 Å2
    Polarizability: 67.3±0.5 10-24cm3
    Surface Tension: 35.1±3.0 dyne/cm
    Molar Volume: 570.1±3.0 cm3

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