ChemSpider 2D Image | (6alpha,11beta,16alpha)-6-Fluoro-11,21-dihydroxy-16-(~2~H_3_)methylpregna-1,4-diene-3,20-dione | C22H26D3FO4

(6α,11β,16α)-6-Fluoro-11,21-dihydroxy-16-(2H3)methylpregna-1,4-diene-3,20-dione

  • Molecular FormulaC22H26D3FO4
  • Average mass379.480 Da
  • Monoisotopic mass379.223816 Da
  • ChemSpider ID58785178
  • 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

(6α,11β,16α)-6-Fluor-11,21-dihydroxy-16-(2H3)methylpregna-1,4-dien-3,20-dion [German] [ACD/IUPAC Name]
(6α,11β,16α)-6-Fluoro-11,21-dihydroxy-16-(2H3)methylpregna-1,4-diene-3,20-dione [ACD/IUPAC Name]
(6α,11β,16α)-6-Fluoro-11,21-dihydroxy-16-(2H3)méthylprégna-1,4-diène-3,20-dione [French] [ACD/IUPAC Name]
Pregna-1,4-diene-3,20-dione, 6-fluoro-11,21-dihydroxy-16-(methyl-d3)-, (6α,11β,16α)- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 537.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.2 mmHg at 25°C
Enthalpy of Vaporization: 93.6±6.0 kJ/mol
Flash Point: 278.8±30.1 °C
Index of Refraction: 1.572
Molar Refractivity: 98.6±0.4 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.86
ACD/LogD (pH 5.5): 2.11
ACD/BCF (pH 5.5): 23.81
ACD/KOC (pH 5.5): 336.54
ACD/LogD (pH 7.4): 2.11
ACD/BCF (pH 7.4): 23.81
ACD/KOC (pH 7.4): 336.54
Polar Surface Area: 75 Å2
Polarizability: 39.1±0.5 10-24cm3
Surface Tension: 49.8±5.0 dyne/cm
Molar Volume: 299.9±5.0 cm3

Click to predict properties on the Chemicalize site






Advertisement