ChemSpider 2D Image | (8xi,9xi,14xi,16alpha,17alpha)-16-(~18~F)Fluoro-19-norpregna-1,3,5(10)-trien-20-yne-3,17-diol | C20H2318FO2

(8ξ,9ξ,14ξ,16α,17α)-16-(18F)Fluoro-19-norpregna-1,3,5(10)-trien-20-yne-3,17-diol

  • Molecular FormulaC20H2318FO2
  • Average mass313.396 Da
  • Monoisotopic mass313.170746 Da
  • ChemSpider ID397408

  • defined stereocentres - 3 of 6 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

(8ξ,9ξ,14ξ,16α,17α)-16-(18F)Fluor-19-norpregna-1,3,5(10)-trien-20-in-3,17-diol [German] [ACD/IUPAC Name]
(8ξ,9ξ,14ξ,16α,17α)-16-(18F)Fluoro-19-norpregna-1,3,5(10)-trien-20-yne-3,17-diol [ACD/IUPAC Name]
(8ξ,9ξ,14ξ,16α,17α)-16-(18F)Fluoro-19-norprégna-1,3,5(10)-trién-20-yne-3,17-diol [French] [ACD/IUPAC Name]
Estra-1,3,5(10)-triene-3,17-diol, 17-ethynyl-16-(fluoro-18F)-, (8ξ,9ξ,14ξ,16α,17β)- [ACD/Index Name]

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

MOLI001768 [DBID]

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.607
Molar Refractivity: 86.4±0.4 cm3
#H bond acceptors:
#H bond donors:
#Freely Rotating Bonds:
#Rule of 5 Violations:
ACD/LogP:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area:
Polarizability: 34.2±0.5 10-24cm3
Surface Tension: 54.5±5.0 dyne/cm
Molar Volume: 250.1±5.0 cm3

Click to predict properties on the Chemicalize site


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