ChemSpider 2D Image | (6alpha,9xi,11beta)-9-Fluoro-11-hydroxy-6-methyl-3,20-dioxopregna-1,4-dien-17-yl acetate | C24H31FO5

(6α,9ξ,11β)-9-Fluoro-11-hydroxy-6-methyl-3,20-dioxopregna-1,4-dien-17-yl acetate

  • Molecular FormulaC24H31FO5
  • Average mass418.498 Da
  • Monoisotopic mass418.215546 Da
  • ChemSpider ID24590290

  • defined stereocentres - 7 of 8 defined stereocentres

More details:

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

(6α,9ξ,11β)-9-Fluor-11-hydroxy-6-methyl-3,20-dioxopregna-1,4-dien-17-yl-acetat [German] [ACD/IUPAC Name]
(6α,9ξ,11β)-9-Fluoro-11-hydroxy-6-methyl-3,20-dioxopregna-1,4-dien-17-yl acetate [ACD/IUPAC Name]
Acétate de (6α,9ξ,11β)-9-fluoro-11-hydroxy-6-méthyl-3,20-dioxoprégna-1,4-dién-17-yle [French] [ACD/IUPAC Name]
Pregna-1,4-diene-3,20-dione, 17-(acetyloxy)-9-fluoro-11-hydroxy-6-methyl-, (6α,9ξ,11β)- [ACD/Index Name]
9-fluoro-11b,17-dihydroxy-6a-methylpregna-1,4-diene-3,20-dione 17-acetate
FLUOROMETHOLONE ACETATE
Jsp000015
Pregna-1,4-diene-3,20-dione,17-(acetyloxy)-9-fluoro-11-hydroxy-6-methyl-, (6a,11b)-

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

Density: 1.2±0.1 g/cm3
Boiling Point: 532.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.2 mmHg at 25°C
Enthalpy of Vaporization: 92.9±6.0 kJ/mol
Flash Point: 275.6±30.1 °C
Index of Refraction: 1.556
Molar Refractivity: 108.3±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.57
ACD/LogD (pH 5.5): 2.64
ACD/BCF (pH 5.5): 59.63
ACD/KOC (pH 5.5): 649.35
ACD/LogD (pH 7.4): 2.64
ACD/BCF (pH 7.4): 59.63
ACD/KOC (pH 7.4): 649.34
Polar Surface Area: 81 Å2
Polarizability: 42.9±0.5 10-24cm3
Surface Tension: 47.5±5.0 dyne/cm
Molar Volume: 336.8±5.0 cm3

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