ChemSpider 2D Image | (3beta,5alpha,6beta,7alpha)-5-Hydroxy-11-oxocholest-8-ene-3,6,7-triyl triacetate | C33H50O8

(3β,5α,6β,7α)-5-Hydroxy-11-oxocholest-8-ene-3,6,7-triyl triacetate

  • Molecular FormulaC33H50O8
  • Average mass574.745 Da
  • Monoisotopic mass574.350586 Da
  • ChemSpider ID9289649

  • defined stereocentres - 9 of 9 defined stereocentres

More details:

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

(3β,5α,6β,7α)-5-Hydroxy-11-oxocholest-8-en-3,6,7-triyl-triacetat [German] [ACD/IUPAC Name]
(3β,5α,6β,7α)-5-Hydroxy-11-oxocholest-8-ene-3,6,7-triyl triacetate [ACD/IUPAC Name]
Cholest-8-en-11-one, 3,6,7-tris(acetyloxy)-5-hydroxy-, (3β,5α,6β,7α)- [ACD/Index Name]
Triacétate de (3β,5α,6β,7α)-5-hydroxy-11-oxocholest-8-ène-3,6,7-triyle [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 619.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.1 mmHg at 25°C
Enthalpy of Vaporization: 105.3±6.0 kJ/mol
Flash Point: 185.3±25.0 °C
Index of Refraction: 1.534
Molar Refractivity: 153.2±0.4 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 6.18
ACD/LogD (pH 5.5): 6.04
ACD/BCF (pH 5.5): 22960.99
ACD/KOC (pH 5.5): 46045.03
ACD/LogD (pH 7.4): 6.04
ACD/BCF (pH 7.4): 22960.86
ACD/KOC (pH 7.4): 46044.77
Polar Surface Area: 116 Å2
Polarizability: 60.7±0.5 10-24cm3
Surface Tension: 46.4±5.0 dyne/cm
Molar Volume: 493.3±5.0 cm3

Click to predict properties on the Chemicalize site


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