ChemSpider 2D Image | (6alpha,10xi,11beta,13xi)-21-Fluoro-11,17-dihydroxy-6-methylpregna-1,4-diene-3,20-dione | C22H29FO4

(6α,10ξ,11β,13ξ)-21-Fluoro-11,17-dihydroxy-6-methylpregna-1,4-diene-3,20-dione

  • Molecular FormulaC22H29FO4
  • Average mass376.462 Da
  • Monoisotopic mass376.204987 Da
  • ChemSpider ID58817224

  • defined stereocentres - 6 of 8 defined stereocentres

More details:

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

(6α,10ξ,11β,13ξ)-21-Fluor-11,17-dihydroxy-6-methylpregna-1,4-dien-3,20-dion [German] [ACD/IUPAC Name]
(6α,10ξ,11β,13ξ)-21-Fluoro-11,17-dihydroxy-6-methylpregna-1,4-diene-3,20-dione [ACD/IUPAC Name]
(6α,10ξ,11β,13ξ)-21-Fluoro-11,17-dihydroxy-6-méthylprégna-1,4-diène-3,20-dione [French] [ACD/IUPAC Name]
Pregna-1,4-diene-3,20-dione, 21-fluoro-11,17-dihydroxy-6-methyl-, (6α,10ξ,11β,13ξ)- [ACD/Index Name]
437-99-0 [RN]
PREGNA-1,4-DIENE-3,20-DIONE,21-FLUORO-11SS,17-DIHYDROXY-6A-METHYL-

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

Density: 1.3±0.1 g/cm3
Boiling Point: 544.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.3 mmHg at 25°C
Enthalpy of Vaporization: 94.6±6.0 kJ/mol
Flash Point: 282.8±30.1 °C
Index of Refraction: 1.574
Molar Refractivity: 98.7±0.4 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.11
ACD/LogD (pH 5.5): 2.26
ACD/BCF (pH 5.5): 30.86
ACD/KOC (pH 5.5): 405.23
ACD/LogD (pH 7.4): 2.26
ACD/BCF (pH 7.4): 30.86
ACD/KOC (pH 7.4): 405.23
Polar Surface Area: 75 Å2
Polarizability: 39.1±0.5 10-24cm3
Surface Tension: 50.4±5.0 dyne/cm
Molar Volume: 299.1±5.0 cm3

Click to predict properties on the Chemicalize site


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