ChemSpider 2D Image | (5alpha)-Ergost-24(28)-ene-3,6-dione | C28H44O2

(5α)-Ergost-24(28)-ene-3,6-dione

  • Molecular FormulaC28H44O2
  • Average mass412.648 Da
  • Monoisotopic mass412.334137 Da
  • ChemSpider ID28283792
  • defined stereocentres - 8 of 8 defined stereocentres


More details:



Featured data source



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

(5α)-Ergost-24(28)-en-3,6-dion [German] [ACD/IUPAC Name]
(5α)-Ergost-24(28)-ene-3,6-dione [ACD/IUPAC Name]
(5α)-Ergost-24(28)-ène-3,6-dione [French] [ACD/IUPAC Name]
Ergost-24(28)-ene-3,6-dione, (5α)- [ACD/Index Name]
5a-ergost-24(28)-ene-3,6-dione

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

Density: 1.0±0.1 g/cm3
Boiling Point: 508.5±33.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 77.9±3.0 kJ/mol
Flash Point: 187.8±22.4 °C
Index of Refraction: 1.508
Molar Refractivity: 123.2±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 7.53
ACD/LogD (pH 5.5): 6.18
ACD/BCF (pH 5.5): 29177.42
ACD/KOC (pH 5.5): 54659.44
ACD/LogD (pH 7.4): 6.18
ACD/BCF (pH 7.4): 29177.42
ACD/KOC (pH 7.4): 54659.44
Polar Surface Area: 34 Å2
Polarizability: 48.8±0.5 10-24cm3
Surface Tension: 35.3±3.0 dyne/cm
Molar Volume: 413.6±3.0 cm3

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