ChemSpider 2D Image | Estra-1,3,5(10)-triene-3,17-diol (17β)-, dicyclopentanepropanoate | C34H48O4

Estra-1,3,5(10)-triene-3,17-diol (17β)-, dicyclopentanepropanoate

  • Molecular FormulaC34H48O4
  • Average mass520.742 Da
  • Monoisotopic mass520.355286 Da
  • ChemSpider ID91987

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

(17β)-Estra-1,3,5(10)-trien-3,17-diyl-bis(3-cyclopentylpropanoat) [German] [ACD/IUPAC Name]
(17β)-Estra-1,3,5(10)-triene-3,17-diyl bis(3-cyclopentylpropanoate) [ACD/IUPAC Name]
211-192-2 [EINECS]
633-36-3 [RN]
Bis(3-cyclopentylpropanoate) de (17β)-estra-1,3,5(10)-triène-3,17-diyle [French] [ACD/IUPAC Name]
Cyclopentanepropanoic acid, (17β)-estra-1,3,5(10)-triene-3,17-diyl ester [ACD/Index Name]
Estra-1,3,5(10)-triene-3,17-diol (17β)-, dicyclopentanepropanoate
estra-1,3,5(10)-triene-3,17β-diol bis(cyclopentanepropionate)
Estradiol Dicypionate

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

Density: 1.1±0.1 g/cm3
Boiling Point: 618.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 91.7±3.0 kJ/mol
Flash Point: 304.4±29.9 °C
Index of Refraction: 1.564
Molar Refractivity: 149.8±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 10.22
ACD/LogD (pH 5.5): 9.28
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 2668994.75
ACD/LogD (pH 7.4): 9.28
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 2668994.75
Polar Surface Area: 53 Å2
Polarizability: 59.4±0.5 10-24cm3
Surface Tension: 47.7±5.0 dyne/cm
Molar Volume: 460.4±5.0 cm3

Click to predict properties on the Chemicalize site


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