ChemSpider 2D Image | (8xi,11beta,14xi)-11-Hydroxy(9,11,12,12-~2~H_4_)androst-4-ene-3,17-dione | C19H22D4O3

(8ξ,11β,14ξ)-11-Hydroxy(9,11,12,12-2H4)androst-4-ene-3,17-dione

  • Molecular FormulaC19H22D4O3
  • Average mass306.433 Da
  • Monoisotopic mass306.213287 Da
  • ChemSpider ID98645516

  • defined stereocentres - 4 of 6 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

(8ξ,11β,14ξ)-11-Hydroxy(9,11,12,12-2H4)androst-4-en-3,17-dion [German] [ACD/IUPAC Name]
(8ξ,11β,14ξ)-11-Hydroxy(9,11,12,12-2H4)androst-4-ene-3,17-dione [ACD/IUPAC Name]
(8ξ,11β,14ξ)-11-Hydroxy(9,11,12,12-2H4)androst-4-ène-3,17-dione [French] [ACD/IUPAC Name]
Androst-4-ene-3,17-dione-9,11,12,12-d4, 11-hydroxy-, (8ξ,11β,14ξ)- [ACD/Index Name]
11β-Hydroxy-4-androstene-3,17-dione-9,11,12,12-d4

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

Density: 1.2±0.1 g/cm3
Boiling Point: 475.3±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 85.2±6.0 kJ/mol
Flash Point: 255.4±25.2 °C
Index of Refraction: 1.569
Molar Refractivity: 83.2±0.4 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 1.27
ACD/LogD (pH 5.5): 1.90
ACD/BCF (pH 5.5): 16.34
ACD/KOC (pH 5.5): 257.11
ACD/LogD (pH 7.4): 1.90
ACD/BCF (pH 7.4): 16.34
ACD/KOC (pH 7.4): 257.11
Polar Surface Area: 54 Å2
Polarizability: 33.0±0.5 10-24cm3
Surface Tension: 48.2±5.0 dyne/cm
Molar Volume: 253.9±5.0 cm3

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