ChemSpider 2D Image | Estradiol furoate | C23H26O4

Estradiol furoate

  • Molecular FormulaC23H26O4
  • Average mass366.450 Da
  • Monoisotopic mass366.183105 Da
  • ChemSpider ID58838618

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

(17β)-3-Hydroxyestra-1(10),2,4-trien-17-yl 2-furoate [ACD/IUPAC Name]
(17β)-3-Hydroxyestra-1(10),2,4-trien-17-yl-2-furoat [German] [ACD/IUPAC Name]
1083178-02-2 [RN]
17-furoylestradiol
2-Furancarboxylic acid, (17β)-3-hydroxyestra-1(10),2,4-trien-17-yl ester [ACD/Index Name]
2-Furoate de (17β)-3-hydroxyestra-1(10),2,4-trién-17-yle [French] [ACD/IUPAC Name]
Estra-1,3,5(10)-triene-3,17-diol, 17-(2-furancarboxylate), (17β)-
Estradiol furoate [Wiki]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 527.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 83.3±3.0 kJ/mol
Flash Point: 273.0±30.1 °C
Index of Refraction: 1.614
Molar Refractivity: 101.3±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 5.84
ACD/LogD (pH 5.5): 4.97
ACD/BCF (pH 5.5): 3552.43
ACD/KOC (pH 5.5): 12107.59
ACD/LogD (pH 7.4): 4.97
ACD/BCF (pH 7.4): 3547.43
ACD/KOC (pH 7.4): 12090.56
Polar Surface Area: 60 Å2
Polarizability: 40.2±0.5 10-24cm3
Surface Tension: 55.2±5.0 dyne/cm
Molar Volume: 290.6±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement