ChemSpider 2D Image | (11beta,17xi)-21-(~125~I)Iodo-11-methoxy-19-norpregna-1,3,5(10)-trien-20-yne-3,17-diol | C21H25125IO3

(11β,17ξ)-21-(125I)Iodo-11-methoxy-19-norpregna-1,3,5(10)-trien-20-yne-3,17-diol

  • Molecular FormulaC21H25125IO3
  • Average mass450.326 Da
  • Monoisotopic mass450.084991 Da
  • ChemSpider ID60439

  • defined stereocentres - 5 of 6 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

(11β,17ξ)-21-(125I)Iod-11-methoxy-19-norpregna-1,3,5(10)-trien-20-in-3,17-diol [German] [ACD/IUPAC Name]
(11β,17ξ)-21-(125I)Iodo-11-methoxy-19-norpregna-1,3,5(10)-trien-20-yne-3,17-diol [ACD/IUPAC Name]
(11β,17ξ)-21-(125I)Iodo-11-méthoxy-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-[2-(iodo-125I)ethynyl]-11-methoxy-, (11β)- [ACD/Index Name]
17α-Iodoethynyl-11β-methoxyestradiol
19-Norpregna-1,3,5(10)-trien-20-yne-3,17-diol, 21-(iodo-125I)-11-methoxy-, (11β,17α)-
73309-87-2 [RN]

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

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.663
Molar Refractivity: 105.8±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: 41.9±0.5 10-24cm3
Surface Tension: 63.0±5.0 dyne/cm
Molar Volume: 285.6±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement