ChemSpider 2D Image | (2S,16alpha)-16,19-Dihydroxy(2,7,7,16-~2~H_4_)androst-4-ene-3,17-dione | C19H22D4O4

(2S,16α)-16,19-Dihydroxy(2,7,7,16-2H4)androst-4-ene-3,17-dione

  • Molecular FormulaC19H22D4O4
  • Average mass322.432 Da
  • Monoisotopic mass322.208221 Da
  • ChemSpider ID8556914

  • 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

(2S,16α)-16,19-Dihydroxy(2,7,7,16-2H4)androst-4-en-3,17-dion [German] [ACD/IUPAC Name]
(2S,16α)-16,19-Dihydroxy(2,7,7,16-2H4)androst-4-ene-3,17-dione [ACD/IUPAC Name]
(2S,16α)-16,19-Dihydroxy(2,7,7,16-2H4)androst-4-ène-3,17-dione [French] [ACD/IUPAC Name]
Androst-4-ene-3,17-dione-2,7,7,16-d4, 16,19-dihydroxy-, (2S,16α)- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 530.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.2 mmHg at 25°C
Enthalpy of Vaporization: 92.7±6.0 kJ/mol
Flash Point: 289.0±26.6 °C
Index of Refraction: 1.590
Molar Refractivity: 84.8±0.4 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -0.07
ACD/LogD (pH 5.5): 1.27
ACD/BCF (pH 5.5): 5.45
ACD/KOC (pH 5.5): 117.19
ACD/LogD (pH 7.4): 1.27
ACD/BCF (pH 7.4): 5.45
ACD/KOC (pH 7.4): 117.19
Polar Surface Area: 75 Å2
Polarizability: 33.6±0.5 10-24cm3
Surface Tension: 55.5±5.0 dyne/cm
Molar Volume: 251.3±5.0 cm3

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