ChemSpider 2D Image | (11beta,17alpha,20E)-21-(~125~I)Iodo-3,11-dimethoxy-19-norpregna-1,3,5(10),20-tetraen-17-ol | C22H29125IO3


  • Molecular FormulaC22H29125IO3
  • Average mass466.368 Da
  • Monoisotopic mass466.116302 Da
  • ChemSpider ID4940750
  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 6 of 6 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

(11β,17α,20E)-21-(125I)Iod-3,11-dimethoxy-19-norpregna-1,3,5(10),20-tetraen-17-ol [German] [ACD/IUPAC Name]
(11β,17α,20E)-21-(125I)Iodo-3,11-dimethoxy-19-norpregna-1,3,5(10),20-tetraen-17-ol [ACD/IUPAC Name]
(11β,17α,20E)-21-(125I)Iodo-3,11-diméthoxy-19-norprégna-1,3,5(10),20-tétraén-17-ol [French] [ACD/IUPAC Name]
Estra-1,3,5(10)-trien-17-ol, 17-[(E)-2-(iodo-125I)ethenyl]-3,11-dimethoxy-, (11β,17β)- [ACD/Index Name]
17-Iodovinyl-11-methoxyestradiol-3-methyl ether
17α-(125I)Iodovinyl-11β-methoxyestradiol-3-methyl ether
19-Norpregna-1,3,5(10),20-tetraen-17-ol, 21-(iodo-125I)-3,11-dimethoxy-, (11β,17α,20E)-
94887-70-4 [RN]

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.619
Molar Refractivity: 112.5±0.4 cm3
#H bond acceptors:
#H bond donors:
#Freely Rotating Bonds:
#Rule of 5 Violations:
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: 44.6±0.5 10-24cm3
Surface Tension: 51.4±5.0 dyne/cm
Molar Volume: 320.5±5.0 cm3

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