ChemSpider 2D Image | (5alpha,14xi)-Cholesta-8,24-dien-3-one | C27H42O

(5α,14ξ)-Cholesta-8,24-dien-3-one

  • Molecular FormulaC27H42O
  • Average mass382.622 Da
  • Monoisotopic mass382.323578 Da
  • ChemSpider ID24850070

  • defined stereocentres - 5 of 6 defined stereocentres

More details:

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

(5α,14ξ)-Cholesta-8,24-dien-3-on [German] [ACD/IUPAC Name]
(5α,14ξ)-Cholesta-8,24-dien-3-one [ACD/IUPAC Name]
(5α,14ξ)-Cholesta-8,24-dién-3-one [French] [ACD/IUPAC Name]
Cholesta-8,24-dien-3-one, (5α,14ξ)- [ACD/Index Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 480.3±44.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 74.5±3.0 kJ/mol
Flash Point: 202.3±23.4 °C
Index of Refraction: 1.530
Molar Refractivity: 118.1±0.4 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 9.08
ACD/LogD (pH 5.5): 7.83
ACD/BCF (pH 5.5): 528401.81
ACD/KOC (pH 5.5): 434579.41
ACD/LogD (pH 7.4): 7.83
ACD/BCF (pH 7.4): 528401.81
ACD/KOC (pH 7.4): 434579.41
Polar Surface Area: 17 Å2
Polarizability: 46.8±0.5 10-24cm3
Surface Tension: 37.8±5.0 dyne/cm
Molar Volume: 382.2±5.0 cm3

Click to predict properties on the Chemicalize site


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