ChemSpider 2D Image | Isocetyl stearate | C34H68O2

Isocetyl stearate

  • Molecular FormulaC34H68O2
  • Average mass508.902 Da
  • Monoisotopic mass508.521942 Da
  • ChemSpider ID82542

More details:

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

Isocetyl stearate
14-Methylpentadecyl stearate [ACD/IUPAC Name]
14-Methylpentadecylstearat [German] [ACD/IUPAC Name]
246-868-6 [EINECS]
25339-09-7 [RN]
3RJ7186O9W
MFCD00053742
Octadecanoic acid, 14-methylpentadecyl ester [ACD/Index Name]
Stéarate de 14-méthylpentadécyle [French] [ACD/IUPAC Name]
UNII:3RJ7186O9W
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 0.9±0.1 g/cm3
    Boiling Point: 522.4±18.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.4 mmHg at 25°C
    Enthalpy of Vaporization: 79.6±3.0 kJ/mol
    Flash Point: 275.9±11.0 °C
    Index of Refraction: 1.456
    Molar Refractivity: 161.3±0.3 cm3
    #H bond acceptors: 2
    #H bond donors: 0
    #Freely Rotating Bonds: 31
    #Rule of 5 Violations: 2
    ACD/LogP: 16.47
    ACD/LogD (pH 5.5): 14.38
    ACD/BCF (pH 5.5): 1000000.00
    ACD/KOC (pH 5.5): 10000000.00
    ACD/LogD (pH 7.4): 14.38
    ACD/BCF (pH 7.4): 1000000.00
    ACD/KOC (pH 7.4): 10000000.00
    Polar Surface Area: 26 Å2
    Polarizability: 63.9±0.5 10-24cm3
    Surface Tension: 31.6±3.0 dyne/cm
    Molar Volume: 593.6±3.0 cm3

    Click to predict properties on the Chemicalize site


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