ChemSpider 2D Image | (6alpha,9xi,11beta,16alpha,17beta)-6,9-Difluoro-11-hydroxy-16-methyl-3-oxo-17-(propionyloxy)androsta-1,4-diene-17-carboxylic acid | C24H30F2O6

(6α,9ξ,11β,16α,17β)-6,9-Difluoro-11-hydroxy-16-methyl-3-oxo-17-(propionyloxy)androsta-1,4-diene-17-carboxylic acid

  • Molecular FormulaC24H30F2O6
  • Average mass452.488 Da
  • Monoisotopic mass452.201050 Da
  • ChemSpider ID28536564

  • defined stereocentres - 8 of 9 defined stereocentres

More details:

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

(6α,9ξ,11β,16α,17β)-6,9-Difluor-11-hydroxy-16-methyl-3-oxo-17-(propionyloxy)androsta-1,4-dien-17-carbonsäure [German] [ACD/IUPAC Name]
(6α,9ξ,11β,16α,17β)-6,9-Difluoro-11-hydroxy-16-methyl-3-oxo-17-(propionyloxy)androsta-1,4-diene-17-carboxylic acid [ACD/IUPAC Name]
Acide (6α,9ξ,11β,16α,17β)-6,9-difluoro-11-hydroxy-16-méthyl-3-oxo-17-(propionyloxy)androsta-1,4-diène-17-carboxylique [French] [ACD/IUPAC Name]
Androsta-1,4-diene-17-carboxylic acid, 6,9-difluoro-11-hydroxy-16-methyl-3-oxo-17-(1-oxopropoxy)-, (6α,9ξ,11β,16α,17β)- [ACD/Index Name]
(6a,11b,16a,17a)-6,9-Difluoro-11-hydroxy-16-methyl-3-oxo-17-(1-oxopropoxy)androsta-1,4-diene-17-carboxylic acid
65429-42-7 [RN]
Fluticasone 17&β;-Carboxylic Acid Propionate
FLUTICASONE PROPIONATE, 17-β CARBOXYLIC ACID
MFCD08063663 [MDL number]
MFCD23135581 [MDL number]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 577.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.6 mmHg at 25°C
Enthalpy of Vaporization: 99.3±6.0 kJ/mol
Flash Point: 303.1±30.1 °C
Index of Refraction: 1.561
Molar Refractivity: 109.9±0.4 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.54
ACD/LogD (pH 5.5): -0.38
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.14
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 101 Å2
Polarizability: 43.6±0.5 10-24cm3
Surface Tension: 51.2±5.0 dyne/cm
Molar Volume: 339.5±5.0 cm3

Click to predict properties on the Chemicalize site


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