ChemSpider 2D Image | 17-Hydroxy-6-methyl-16-methylene(2,2,21,21,21-~2~H_5_)pregna-4,6-diene-3,20-dione | C23H25D5O3

17-Hydroxy-6-methyl-16-methylene(2,2,21,21,21-2H5)pregna-4,6-diene-3,20-dione

  • Molecular FormulaC23H25D5O3
  • Average mass359.513 Da
  • Monoisotopic mass359.250885 Da
  • ChemSpider ID115011156

  • defined stereocentres - 6 of 6 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

17-Hydroxy-6-methyl-16-methylen(2,2,21,21,21-2H5)pregna-4,6-dien-3,20-dion [German] [ACD/IUPAC Name]
17-Hydroxy-6-methyl-16-methylene(2,2,21,21,21-2H5)pregna-4,6-diene-3,20-dione [ACD/IUPAC Name]
17-Hydroxy-6-méthyl-16-méthylène(2,2,21,21,21-2H5)prégna-4,6-diène-3,20-dione [French] [ACD/IUPAC Name]
Pregna-4,6-diene-3,20-dione-2,2,21,21,21-d5, 17-hydroxy-6-methyl-16-methylene- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 512.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.0 mmHg at 25°C
Enthalpy of Vaporization: 90.2±6.0 kJ/mol
Flash Point: 277.8±26.6 °C
Index of Refraction: 1.572
Molar Refractivity: 101.0±0.4 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 3.42
ACD/LogD (pH 5.5): 3.66
ACD/BCF (pH 5.5): 354.76
ACD/KOC (pH 5.5): 2327.28
ACD/LogD (pH 7.4): 3.66
ACD/BCF (pH 7.4): 354.76
ACD/KOC (pH 7.4): 2327.25
Polar Surface Area: 54 Å2
Polarizability: 40.0±0.5 10-24cm3
Surface Tension: 45.5±5.0 dyne/cm
Molar Volume: 306.8±5.0 cm3

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