ChemSpider 2D Image | ioflupane (~123~I) | C18H23F123INO2

ioflupane (123I)

  • Molecular FormulaC18H23F123INO2
  • Average mass427.379 Da
  • Monoisotopic mass427.171295 Da
  • ChemSpider ID2343241

  • defined stereocentres - 4 of 4 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

(1R,2S,3S,5S)-8-(3-Fluoropropyl)-3-[4-(123I)iodophényl]-8-azabicyclo[3.2.1]octane-2-carboxylate de méthyle [French] [ACD/IUPAC Name]
123I-ioflupane
155798-07-5 [RN]
3MM99T8R5Q
8-Azabicyclo[3.2.1]octane-2-carboxylic acid, 8-(3-fluoropropyl)-3-[4-(iodo-123I)phenyl]-, methyl ester, (1R,2S,3S,5S)- [ACD/Index Name]
ioflupane (123I) [INN] [Wiki]
ioflupane (123I) [French] [INN]
IOFLUPANE I-123
ioflupano (123I) [Spanish] [INN]
ioflupanum (123I) [Latin] [INN]
More...

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

7500 [DBID]
  • Miscellaneous

    • Chemical Class:

      An azabicycloalkane that is ecgonine methyl ester in which the <element>N</element>-methyl group is replaced by 3-fluoropropyl and the 3<stereo>beta</stereo>-hydroxy group is replaced by 4-(<smallsup> 123</smallsup>I)iodophenyl. Used for the imaging of dopamine transporters in the brain of adult patients with potential Parkinsonian Syndromes. ChEBI CHEBI:68855
      An azabicycloalkane that is ecgonine methyl ester in which the N-methyl group is replaced by 3-fluoropropyl and the 3beta-hydroxy group is replaced by 4-((123)I)iodophenyl. Used for the imaging of dop amine transporters in the brain of adult patients with potential Parkinsonian Syndromes. ChEBI CHEBI:68855
      An azabicycloalkane that is ecgonine methyl ester in which the N-methyl group is replaced by 3-fluoropropyl and the 3beta-hydroxy group is replaced by 4-(; 123I)iodophenyl. Used for the imaging of dop amine transporters in the brain of adult patients with potential Parkinsonian Syndromes. ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:68855

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.561
Molar Refractivity: 96.3±0.3 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: 38.2±0.5 10-24cm3
Surface Tension: 40.9±3.0 dyne/cm
Molar Volume: 297.4±3.0 cm3

Click to predict properties on the Chemicalize site


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