ChemSpider 2D Image | (14beta,17beta)-Estra-1,3,5(10),6,8-pentaene-3,17-diol | C18H20O2

(14β,17β)-Estra-1,3,5(10),6,8-pentaene-3,17-diol

  • Molecular FormulaC18H20O2
  • Average mass268.350 Da
  • Monoisotopic mass268.146332 Da
  • ChemSpider ID31046118

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

(14β,17β)-Estra-1,3,5(10),6,8-pentaen-3,17-diol [German] [ACD/IUPAC Name]
(14β,17β)-Estra-1,3,5(10),6,8-pentaene-3,17-diol [ACD/IUPAC Name]
(14β,17β)-Estra-1,3,5(10),6,8-pentaène-3,17-diol [French] [ACD/IUPAC Name]
Estra-1,3,5(10),6,8-pentaene-3,17-diol, (14β,17β)- [ACD/Index Name]
17a-Dihydro Equilenin
17b-Dihydro Equilenin
6639-99-2 [RN]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 472.5±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 77.5±3.0 kJ/mol
Flash Point: 226.1±23.3 °C
Index of Refraction: 1.677
Molar Refractivity: 80.8±0.3 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 4.14
ACD/LogD (pH 5.5): 3.65
ACD/BCF (pH 5.5): 352.67
ACD/KOC (pH 5.5): 2317.40
ACD/LogD (pH 7.4): 3.65
ACD/BCF (pH 7.4): 351.21
ACD/KOC (pH 7.4): 2307.84
Polar Surface Area: 40 Å2
Polarizability: 32.1±0.5 10-24cm3
Surface Tension: 57.1±3.0 dyne/cm
Molar Volume: 214.8±3.0 cm3

Click to predict properties on the Chemicalize site


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