ChemSpider 2D Image | (17beta)-3-Fluoro-2-methoxyestra-1(10),2,4-trien-17-ol | C19H25FO2

(17β)-3-Fluoro-2-methoxyestra-1(10),2,4-trien-17-ol

  • Molecular FormulaC19H25FO2
  • Average mass304.399 Da
  • Monoisotopic mass304.183868 Da
  • ChemSpider ID24656416
  • defined stereocentres - 5 of 5 defined stereocentres


More details:






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

(17β)-3-Fluor-2-methoxyestra-1(10),2,4-trien-17-ol [German] [ACD/IUPAC Name]
(17β)-3-Fluoro-2-methoxyestra-1(10),2,4-trien-17-ol [ACD/IUPAC Name]
(17β)-3-Fluoro-2-méthoxyestra-1(10),2,4-trién-17-ol [French] [ACD/IUPAC Name]
Estra-1(10),2,4-trien-17-ol, 3-fluoro-2-methoxy-, (17β)- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 422.2±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 71.3±3.0 kJ/mol
Flash Point: 189.5±25.2 °C
Index of Refraction: 1.556
Molar Refractivity: 84.3±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 4.78
ACD/LogD (pH 5.5): 4.00
ACD/BCF (pH 5.5): 647.57
ACD/KOC (pH 5.5): 3580.31
ACD/LogD (pH 7.4): 4.00
ACD/BCF (pH 7.4): 647.57
ACD/KOC (pH 7.4): 3580.31
Polar Surface Area: 29 Å2
Polarizability: 33.4±0.5 10-24cm3
Surface Tension: 41.0±3.0 dyne/cm
Molar Volume: 262.4±3.0 cm3

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