ChemSpider 2D Image | (11beta,16alpha,17alpha)-9-Fluoro-11-hydroxy-16-methyl-3-oxoandrosta-1,4-diene-17-carboxylic acid | C21H27FO4

(11β,16α,17α)-9-Fluoro-11-hydroxy-16-methyl-3-oxoandrosta-1,4-diene-17-carboxylic acid

  • Molecular FormulaC21H27FO4
  • Average mass362.435 Da
  • Monoisotopic mass362.189331 Da
  • ChemSpider ID57546436

  • defined stereocentres - 8 of 8 defined stereocentres

More details:

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

(11β,16α,17α)-9-Fluor-11-hydroxy-16-methyl-3-oxoandrosta-1,4-dien-17-carbonsäure [German] [ACD/IUPAC Name]
(11β,16α,17α)-9-Fluoro-11-hydroxy-16-methyl-3-oxoandrosta-1,4-diene-17-carboxylic acid [ACD/IUPAC Name]
Acide (11β,16α,17α)-9-fluoro-11-hydroxy-16-méthyl-3-oxoandrosta-1,4-diène-17-carboxylique [French] [ACD/IUPAC Name]
Androsta-1,4-diene-17-carboxylic acid, 9-fluoro-11-hydroxy-16-methyl-3-oxo-, (11β,16α,17α)- [ACD/Index Name]
17|A-Carboxy-17-desoxy Dexamethasone
75262-69-0 [RN]
missing

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

Density: 1.3±0.1 g/cm3
Boiling Point: 529.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.2 mmHg at 25°C
Enthalpy of Vaporization: 92.5±6.0 kJ/mol
Flash Point: 273.9±30.1 °C
Index of Refraction: 1.579
Molar Refractivity: 94.0±0.4 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.52
ACD/LogD (pH 5.5): 1.28
ACD/BCF (pH 5.5): 3.07
ACD/KOC (pH 5.5): 38.98
ACD/LogD (pH 7.4): -0.53
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 75 Å2
Polarizability: 37.3±0.5 10-24cm3
Surface Tension: 51.2±5.0 dyne/cm
Molar Volume: 282.9±5.0 cm3

Click to predict properties on the Chemicalize site


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