ChemSpider 2D Image | 3-(Cyclopentyloxy)-19-norpregna-1,3,5(10)-trien-20-yne-16,17-diol | C25H32O3

3-(Cyclopentyloxy)-19-norpregna-1,3,5(10)-trien-20-yne-16,17-diol

  • Molecular FormulaC25H32O3
  • Average mass380.520 Da
  • Monoisotopic mass380.235138 Da
  • ChemSpider ID11644606

More details:






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

3-(Cyclopentyloxy)-19-norpregna-1,3,5(10)-trien-20-in-16,17-diol [German] [ACD/IUPAC Name]
3-(Cyclopentyloxy)-19-norpregna-1,3,5(10)-trien-20-yne-16,17-diol [ACD/IUPAC Name]
3-(Cyclopentyloxy)-19-norprégna-1,3,5(10)-trién-20-yne-16,17-diol [French] [ACD/IUPAC Name]
Estra-1,3,5(10)-triene-16,17-diol, 3-(cyclopentyloxy)-17-ethynyl- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 521.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 83.7±3.0 kJ/mol
Flash Point: 269.3±30.1 °C
Index of Refraction: 1.612
Molar Refractivity: 109.1±0.4 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 5.74
ACD/LogD (pH 5.5): 4.47
ACD/BCF (pH 5.5): 1458.88
ACD/KOC (pH 5.5): 6403.29
ACD/LogD (pH 7.4): 4.47
ACD/BCF (pH 7.4): 1458.87
ACD/KOC (pH 7.4): 6403.24
Polar Surface Area: 50 Å2
Polarizability: 43.2±0.5 10-24cm3
Surface Tension: 56.3±5.0 dyne/cm
Molar Volume: 313.9±5.0 cm3

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