ChemSpider 2D Image | MFCD00216162 | C27H44D4

MFCD00216162

  • Molecular FormulaC27H44D4
  • Average mass376.695 Da
  • Monoisotopic mass376.400696 Da
  • ChemSpider ID32819384

  • defined stereocentres - 8 of 8 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

(5α)-(2,2,4,4-2H4)Cholestan [German] [ACD/IUPAC Name]
(5α)-(2,2,4,4-2H4)Cholestane [ACD/IUPAC Name]
(5α)-(2,2,4,4-2H4)Cholestane [French] [ACD/IUPAC Name]
205529-74-4 [RN]
5α-Cholestane-2,2,4,4-d4
Cholestane-2,2,4,4-d4, (5α)- [ACD/Index Name]
D4 C27 α α α (20R) CHOLESTANE
MFCD00216162
(5S,8R,9S,10S,13R,14S,17R)-2,2,4,4-tetradeuterio-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-3,5,6,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene
??-cholestane-d4
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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: 440.9±12.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.5 mmHg at 25°C
    Enthalpy of Vaporization: 67.1±0.8 kJ/mol
    Flash Point: 210.3±13.1 °C
    Index of Refraction: 1.492
    Molar Refractivity: 118.8±0.3 cm3
    #H bond acceptors: 0
    #H bond donors: 0
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 1
    ACD/LogP: 12.26
    ACD/LogD (pH 5.5): 10.52
    ACD/BCF (pH 5.5): 1000000.00
    ACD/KOC (pH 5.5): 10000000.00
    ACD/LogD (pH 7.4): 10.52
    ACD/BCF (pH 7.4): 1000000.00
    ACD/KOC (pH 7.4): 10000000.00
    Polar Surface Area: 0 Å2
    Polarizability: 47.1±0.5 10-24cm3
    Surface Tension: 31.9±3.0 dyne/cm
    Molar Volume: 409.2±3.0 cm3

    Click to predict properties on the Chemicalize site


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