ChemSpider 2D Image | (6alpha,11beta,16alpha,17alpha)-6,9-Difluoro-17-{[(fluoromethyl)sulfanyl]carbonyl}-11-hydroxy-16-methyl-3-oxoandrosta-1,4-dien-17-yl (~2~H_5_)propanoate | C25H26D5F3O5S

(6α,11β,16α,17α)-6,9-Difluoro-17-{[(fluoromethyl)sulfanyl]carbonyl}-11-hydroxy-16-methyl-3-oxoandrosta-1,4-dien-17-yl (2H5)propanoate

  • Molecular FormulaC25H26D5F3O5S
  • Average mass505.602 Da
  • Monoisotopic mass505.215820 Da
  • ChemSpider ID45383188

  • defined stereocentres - 9 of 9 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

(2H5)Propanoate de (6α,11β,16α,17α)-6,9-difluoro-17-{[(fluorométhyl)sulfanyl]carbonyl}-11-hydroxy-16-méthyl-3-oxoandrosta-1,4-dién-17-yle [French] [ACD/IUPAC Name]
(6α,11β,16α,17α)-6,9-Difluor-17-{[(fluormethyl)sulfanyl]carbonyl}-11-hydroxy-16-methyl-3-oxoandrosta-1,4-dien-17-yl-(2H5)propanoat [German] [ACD/IUPAC Name]
(6α,11β,16α,17α)-6,9-Difluoro-17-{[(fluoromethyl)sulfanyl]carbonyl}-11-hydroxy-16-methyl-3-oxoandrosta-1,4-dien-17-yl (2H5)propanoate [ACD/IUPAC Name]
1093258-28-6 [RN]
Propanoic-d5 acid, (6α,11β,16α,17α)-6,9-difluoro-17-[[(fluoromethyl)thio]carbonyl]-11-hydroxy-16-methyl-3-oxoandrosta-1,4-dien-17-yl ester [ACD/Index Name]
[(6S,8S,9R,10S,11S,13S,14S,16R,17R)-6,9-difluoro-17-(fluoromethylsulfanylcarbonyl)-11-hydroxy-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl] 2,2,3,3,3-pentadeuteriopropanoate
FLUTICASONE PROPIONATE-D5
Fluticasone-d5 propionate
MFCD08064194 [MDL number]
SS-4490

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 568.3±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±3.5 mmHg at 25°C
    Enthalpy of Vaporization: 98.0±6.0 kJ/mol
    Flash Point: 297.5±30.1 °C
    Index of Refraction: 1.556
    Molar Refractivity: 121.1±0.4 cm3
    #H bond acceptors: 5
    #H bond donors: 1
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 1
    ACD/LogP: 3.73
    ACD/LogD (pH 5.5): 3.71
    ACD/BCF (pH 5.5): 391.28
    ACD/KOC (pH 5.5): 2496.35
    ACD/LogD (pH 7.4): 3.71
    ACD/BCF (pH 7.4): 391.27
    ACD/KOC (pH 7.4): 2496.33
    Polar Surface Area: 106 Å2
    Polarizability: 48.0±0.5 10-24cm3
    Surface Tension: 48.1±5.0 dyne/cm
    Molar Volume: 377.0±5.0 cm3

    Click to predict properties on the Chemicalize site


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