ChemSpider 2D Image | (3beta,5alpha,17beta)-(2,3,4,4-~2~H_4_)Androst-1-ene-3,17-diol | C19H26D4O2

(3β,5α,17β)-(2,3,4,4-2H4)Androst-1-ene-3,17-diol

  • Molecular FormulaC19H26D4O2
  • Average mass294.465 Da
  • Monoisotopic mass294.249695 Da
  • ChemSpider ID58780669
  • defined stereocentres - 8 of 8 defined stereocentres

    Non-standard isotope - Non-standard isotope


More details:






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

(3β,5α,17β)-(2,3,4,4-2H4)Androst-1-en-3,17-diol [German] [ACD/IUPAC Name]
(3β,5α,17β)-(2,3,4,4-2H4)Androst-1-ene-3,17-diol [ACD/IUPAC Name]
(3β,5α,17β)-(2,3,4,4-2H4)Androst-1-ène-3,17-diol [French] [ACD/IUPAC Name]
Androst-1-ene-2,3,4,4-d4-3,17-diol, (3β,5α,17β)- [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: 418.0±38.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 77.6±6.0 kJ/mol
Flash Point: 188.8±21.4 °C
Index of Refraction: 1.560
Molar Refractivity: 84.6±0.3 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 3.97
ACD/LogD (pH 5.5): 3.30
ACD/BCF (pH 5.5): 190.09
ACD/KOC (pH 5.5): 1489.00
ACD/LogD (pH 7.4): 3.30
ACD/BCF (pH 7.4): 190.09
ACD/KOC (pH 7.4): 1489.00
Polar Surface Area: 40 Å2
Polarizability: 33.5±0.5 10-24cm3
Surface Tension: 44.9±3.0 dyne/cm
Molar Volume: 261.4±3.0 cm3

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