ChemSpider 2D Image | MFCD06658847 | C27H43D5O

MFCD06658847

  • Molecular FormulaC27H43D5O
  • Average mass393.700 Da
  • Monoisotopic mass393.401886 Da
  • ChemSpider ID58824726

  • defined stereocentres - 9 of 9 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

(3β,5α)-(2,2,3,4,4-2H5)Cholestan-3-ol [German] [ACD/IUPAC Name]
(3β,5α)-(2,2,3,4,4-2H5)Cholestan-3-ol [ACD/IUPAC Name]
(3β,5α)-(2,2,3,4,4-2H5)Cholestan-3-ol [French] [ACD/IUPAC Name]
5α-Cholestan-3β-ol-2,2,3,4,4-d5
Cholestan-2,2,3,4,4-d5-3-ol, (3β,5α)- [ACD/Index Name]
MFCD06658847

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

Density: 1.0±0.1 g/cm3
Boiling Point: 455.5±13.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 82.5±6.0 kJ/mol
Flash Point: 190.7±12.3 °C
Index of Refraction: 1.504
Molar Refractivity: 120.4±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 10.22
ACD/LogD (pH 5.5): 8.94
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 1749547.13
ACD/LogD (pH 7.4): 8.94
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 1749547.13
Polar Surface Area: 20 Å2
Polarizability: 47.7±0.5 10-24cm3
Surface Tension: 34.9±3.0 dyne/cm
Molar Volume: 406.1±3.0 cm3

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