ChemSpider 2D Image | (3beta,7alpha,8xi,9xi,14xi)-3-Acetoxy-17-oxoandrost-5-en-7-yl palmitate | C37H60O5

(3β,7α,8ξ,9ξ,14ξ)-3-Acetoxy-17-oxoandrost-5-en-7-yl palmitate

  • Molecular FormulaC37H60O5
  • Average mass584.869 Da
  • Monoisotopic mass584.444092 Da
  • ChemSpider ID8364084

  • defined stereocentres - 4 of 7 defined stereocentres

More details:

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

(3β,7α,8ξ,9ξ,14ξ)-3-Acetoxy-17-oxoandrost-5-en-7-yl palmitate [ACD/IUPAC Name]
(3β,7α,8ξ,9ξ,14ξ)-3-Acetoxy-17-oxoandrost-5-en-7-ylpalmitat [German] [ACD/IUPAC Name]
Hexadecanoic acid, (3β,7α,8ξ,9ξ,14ξ)-3-(acetyloxy)-17-oxoandrost-5-en-7-yl ester [ACD/Index Name]
Palmitate de (3β,7α,8ξ,9ξ,14ξ)-3-acétoxy-17-oxoandrost-5-én-7-yle [French] [ACD/IUPAC 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: 638.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 94.3±3.0 kJ/mol
Flash Point: 259.0±31.5 °C
Index of Refraction: 1.518
Molar Refractivity: 168.6±0.4 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 18
#Rule of 5 Violations: 2
ACD/LogP: 10.89
ACD/LogD (pH 5.5): 10.61
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 10.61
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 70 Å2
Polarizability: 66.8±0.5 10-24cm3
Surface Tension: 42.1±5.0 dyne/cm
Molar Volume: 556.1±5.0 cm3

Click to predict properties on the Chemicalize site


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