ChemSpider 2D Image | (17beta)-3-Oxo(16,16,17-~2~H_3_)androst-4-en-17-yl heptanoate | C26H37D3O3

(17β)-3-Oxo(16,16,17-2H3)androst-4-en-17-yl heptanoate

  • Molecular FormulaC26H37D3O3
  • Average mass403.612 Da
  • Monoisotopic mass403.316589 Da
  • ChemSpider ID25196716

  • defined stereocentres - 1 of 6 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

(17β)-3-Oxo(16,16,17-2H3)androst-4-en-17-yl heptanoate [ACD/IUPAC Name]
(17β)-3-Oxo(16,16,17-2H3)androst-4-en-17-yl-heptanoat [German] [ACD/IUPAC Name]
Heptanoate de (17β)-3-oxo(16,16,17-2H3)androst-4-én-17-yle [French] [ACD/IUPAC Name]
Heptanoic acid, (17β)-3-oxoandrost-4-en-17-yl-16,16,17-d3 ester [ACD/Index Name]
Testosterone-16,16,17-d3 Heptanoate

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

Density: 1.1±0.1 g/cm3
Boiling Point: 503.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 77.3±3.0 kJ/mol
Flash Point: 214.2±30.2 °C
Index of Refraction: 1.529
Molar Refractivity: 115.9±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 7.03
ACD/LogD (pH 5.5): 6.35
ACD/BCF (pH 5.5): 39138.11
ACD/KOC (pH 5.5): 67447.55
ACD/LogD (pH 7.4): 6.35
ACD/BCF (pH 7.4): 39138.11
ACD/KOC (pH 7.4): 67447.55
Polar Surface Area: 43 Å2
Polarizability: 45.9±0.5 10-24cm3
Surface Tension: 41.3±5.0 dyne/cm
Molar Volume: 375.9±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement