ChemSpider 2D Image | 14-Hydroxy-20-oxo-3,9-epoxypregnane-3,11,18-triyl triacetate | C27H38O9

14-Hydroxy-20-oxo-3,9-epoxypregnane-3,11,18-triyl triacetate

  • Molecular FormulaC27H38O9
  • Average mass506.585 Da
  • Monoisotopic mass506.251587 Da
  • ChemSpider ID470848

More details:

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

14-Hydroxy-20-oxo-3,9-epoxypregnan-3,11,18-triyl-triacetat [German] [ACD/IUPAC Name]
14-Hydroxy-20-oxo-3,9-epoxypregnane-3,11,18-triyl triacetate [ACD/IUPAC Name]
Pregnan-20-one, 3,11,18-tris(acetyloxy)-3,9-epoxy-14-hydroxy- [ACD/Index Name]
Triacétate de 14-hydroxy-20-oxo-3,9-époxyprégnane-3,11,18-triyle [French] [ACD/IUPAC Name]
3,9-Epoxypregnan-14-ol-20-one, 3,11,18-triacetoxy-

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

Density: 1.3±0.1 g/cm3
Boiling Point: 589.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.8 mmHg at 25°C
Enthalpy of Vaporization: 101.0±6.0 kJ/mol
Flash Point: 188.9±23.6 °C
Index of Refraction: 1.558
Molar Refractivity: 125.8±0.4 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 2.03
ACD/LogD (pH 5.5): 2.33
ACD/BCF (pH 5.5): 34.81
ACD/KOC (pH 5.5): 441.76
ACD/LogD (pH 7.4): 2.33
ACD/BCF (pH 7.4): 34.81
ACD/KOC (pH 7.4): 441.76
Polar Surface Area: 125 Å2
Polarizability: 49.9±0.5 10-24cm3
Surface Tension: 53.9±5.0 dyne/cm
Molar Volume: 390.0±5.0 cm3

Click to predict properties on the Chemicalize site


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