ChemSpider 2D Image | (9xi,16alpha)-17-Hydroxy-16-methyl-3,20-dioxo(2-~3~H)-9,11-epoxypregna-1,4-dien-21-yl acetate | C24H29TO6

(9ξ,16α)-17-Hydroxy-16-methyl-3,20-dioxo(2-3H)-9,11-epoxypregna-1,4-dien-21-yl acetate

  • Molecular FormulaC24H29TO6
  • Average mass416.500 Da
  • Monoisotopic mass416.212463 Da
  • ChemSpider ID8426827

  • defined stereocentres - 6 of 8 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

(9ξ,16α)-17-Hydroxy-16-methyl-3,20-dioxo(2-3H)-9,11-epoxypregna-1,4-dien-21-yl acetate [ACD/IUPAC Name]
(9ξ,16α)-17-Hydroxy-16-methyl-3,20-dioxo(2-3H)-9,11-epoxypregna-1,4-dien-21-yl-acetat [German] [ACD/IUPAC Name]
Acétate de (9ξ,16α)-17-hydroxy-16-méthyl-3,20-dioxo(2-3H)-9,11-époxyprégna-1,4-dién-21-yle [French] [ACD/IUPAC Name]
Pregna-1,4-diene-3,20-dione-2-t, 21-(acetyloxy)-9,11-epoxy-17-hydroxy-16-methyl-, (9ξ,16α)- [ACD/Index Name]

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

Density:
Boiling Point: 575.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.6 mmHg at 25°C
Enthalpy of Vaporization: 98.9±6.0 kJ/mol
Flash Point: 195.8±23.6 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.32
ACD/LogD (pH 5.5): 2.60
ACD/BCF (pH 5.5): 55.30
ACD/KOC (pH 5.5): 615.27
ACD/LogD (pH 7.4): 2.60
ACD/BCF (pH 7.4): 55.30
ACD/KOC (pH 7.4): 615.27
Polar Surface Area: 93 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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