ChemSpider 2D Image | (3beta)-3-Hydroxy(7,7-~2~H_2_)androst-5-en-17-one | C19H26D2O2

(3β)-3-Hydroxy(7,7-2H2)androst-5-en-17-one

  • Molecular FormulaC19H26D2O2
  • Average mass290.437 Da
  • Monoisotopic mass290.221497 Da
  • ChemSpider ID8261175

  • 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

(3β)-3-Hydroxy(7,7-2H2)androst-5-en-17-on [German] [ACD/IUPAC Name]
(3β)-3-Hydroxy(7,7-2H2)androst-5-en-17-one [ACD/IUPAC Name]
(3β)-3-Hydroxy(7,7-2H2)androst-5-én-17-one [French] [ACD/IUPAC Name]
Androst-5-en-17-one-7,7-d2, 3-hydroxy-, (3β)- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 426.7±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 78.7±6.0 kJ/mol
Flash Point: 182.1±21.3 °C
Index of Refraction: 1.560
Molar Refractivity: 83.1±0.4 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 3.42
ACD/LogD (pH 5.5): 3.44
ACD/BCF (pH 5.5): 241.14
ACD/KOC (pH 5.5): 1765.35
ACD/LogD (pH 7.4): 3.44
ACD/BCF (pH 7.4): 241.14
ACD/KOC (pH 7.4): 1765.35
Polar Surface Area: 37 Å2
Polarizability: 32.9±0.5 10-24cm3
Surface Tension: 44.5±5.0 dyne/cm
Molar Volume: 257.0±5.0 cm3

Click to predict properties on the Chemicalize site


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