ChemSpider 2D Image | (17beta)-17-Hydroxy(16,16,17-~2~H_3_)androstan-3-one | C19H27D3O2

(17β)-17-Hydroxy(16,16,17-2H3)androstan-3-one

  • Molecular FormulaC19H27D3O2
  • Average mass293.459 Da
  • Monoisotopic mass293.243408 Da
  • ChemSpider ID77001581
  • defined stereocentres - 6 of 7 defined stereocentres

    Non-standard isotope - Non-standard isotope


More details:






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

(17β)-17-Hydroxy(16,16,17-2H3)androstan-3-on [German] [ACD/IUPAC Name]
(17β)-17-Hydroxy(16,16,17-2H3)androstan-3-one [ACD/IUPAC Name]
(17β)-17-Hydroxy(16,16,17-2H3)androstan-3-one [French] [ACD/IUPAC Name]
Androstan-3-one-16,16,17-d3, 17-hydroxy-, (17β)- [ACD/Index Name]
200-659-6 [EINECS]
5α-Dihydrotestosterone-d3 (16,16,17-d3)
79037-34-6 [RN]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 413.1±38.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 76.9±6.0 kJ/mol
Flash Point: 176.4±19.4 °C
Index of Refraction: 1.536
Molar Refractivity: 83.5±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 3.75
ACD/LogD (pH 5.5): 3.69
ACD/BCF (pH 5.5): 375.87
ACD/KOC (pH 5.5): 2425.60
ACD/LogD (pH 7.4): 3.69
ACD/BCF (pH 7.4): 375.87
ACD/KOC (pH 7.4): 2425.60
Polar Surface Area: 37 Å2
Polarizability: 33.1±0.5 10-24cm3
Surface Tension: 41.1±3.0 dyne/cm
Molar Volume: 267.6±3.0 cm3

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