ChemSpider 2D Image | 3-Hydroxy-16,17-epoxyestra-1,3,5(10)-triene-17-carbonitrile | C19H21NO2

3-Hydroxy-16,17-epoxyestra-1,3,5(10)-triene-17-carbonitrile

  • Molecular FormulaC19H21NO2
  • Average mass295.375 Da
  • Monoisotopic mass295.157227 Da
  • ChemSpider ID26503137

More details:

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

3-Hydroxy-16,17-epoxyestra-1,3,5(10)-trien-17-carbonitril [German] [ACD/IUPAC Name]
3-Hydroxy-16,17-epoxyestra-1,3,5(10)-triene-17-carbonitrile [ACD/IUPAC Name]
3-Hydroxy-16,17-époxyestra-1,3,5(10)-triène-17-carbonitrile [French] [ACD/IUPAC Name]
Estra-1,3,5(10)-triene-17-carbonitrile, 16,17-epoxy-3-hydroxy- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 500.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 79.9±3.0 kJ/mol
Flash Point: 256.7±30.1 °C
Index of Refraction: 1.639
Molar Refractivity: 81.9±0.4 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.90
ACD/LogD (pH 5.5): 3.17
ACD/BCF (pH 5.5): 151.95
ACD/KOC (pH 5.5): 1268.43
ACD/LogD (pH 7.4): 3.17
ACD/BCF (pH 7.4): 151.71
ACD/KOC (pH 7.4): 1266.47
Polar Surface Area: 57 Å2
Polarizability: 32.5±0.5 10-24cm3
Surface Tension: 60.3±5.0 dyne/cm
Molar Volume: 227.5±5.0 cm3

Click to predict properties on the Chemicalize site


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