ChemSpider 2D Image | (5alpha,8xi,9xi,14xi,20S)-Cholestane | C27H48

(5α,8ξ,9ξ,14ξ,20S)-Cholestane

  • Molecular FormulaC27H48
  • Average mass372.670 Da
  • Monoisotopic mass372.375610 Da
  • ChemSpider ID27473050

  • defined stereocentres - 4 of 8 defined stereocentres

More details:

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

(5α,8ξ,9ξ,14ξ,20S)-Cholestan [German] [ACD/IUPAC Name]
(5α,8ξ,9ξ,14ξ,20S)-Cholestane [ACD/IUPAC Name]
(5α,8ξ,9ξ,14ξ,20S)-Cholestane [French] [ACD/IUPAC Name]
Cholestane, (5α,8ξ,9ξ,14ξ,20S)- [ACD/Index Name]

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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