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Search term: JJKOTMDDZAJTGQ-DQSJHHFOSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | Idoxifene | C28H30INO

Idoxifene

  • Molecular FormulaC28H30INO
  • Average mass523.448 Da
  • Monoisotopic mass523.137207 Da
  • ChemSpider ID2298565

  • Double-bond stereo - Double-bond stereo

More details:

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

(E)-1-(2-(4-(1-(4-Iodophenyl)-2-phenylbut-1-en-1-yl)phenoxy)ethyl)pyrrolidine
1-(2-(4-((1E)-1-(4-Iodophenyl)-2-phenylbut-1-enyl)phenoxy)ethyl)pyrrolidine
1-(2-{4-[(1E)-1-(4-Iodophenyl)-2-phenyl-1-buten-1-yl]phenoxy}ethyl)pyrrolidine [ACD/IUPAC Name]
1-(2-{4-[(1E)-1-(4-Iodophényl)-2-phényl-1-butén-1-yl]phénoxy}éthyl)pyrrolidine [French] [ACD/IUPAC Name]
1-(2-{4-[(1E)-1-(4-Iodophenyl)-2-phenylbut-1-en-1-yl]phenoxy}ethyl)pyrrolidine
1-(2-{4-[(1E)-1-(4-Iodphenyl)-2-phenyl-1-buten-1-yl]phenoxy}ethyl)pyrrolidin [German] [ACD/IUPAC Name]
116057-75-1 [RN]
Idoxifene [BAN] [INN] [USAN] [Wiki]
Pyrrolidine, 1-[2-[4-[(1E)-1-(4-iodophenyl)-2-phenyl-1-buten-1-yl]phenoxy]ethyl]- [ACD/Index Name]
(E)-1-(2-(4-(1-(4-Iodophenyl)-2-phenyl-1-butenyl)phenoxy)ethyl)pyrrolidine
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

456UXE9867 [DBID]
7029 [DBID]
CB 7432 [DBID]
CB-7432 [DBID]
SB 223030 [DBID]
SB-223030 [DBID]
UNII:456UXE9867 [DBID]
UNII-456UXE9867 [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: 573.4±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.6 mmHg at 25°C
    Enthalpy of Vaporization: 85.9±3.0 kJ/mol
    Flash Point: 300.6±30.1 °C
    Index of Refraction: 1.623
    Molar Refractivity: 138.8±0.3 cm3
    #H bond acceptors: 2
    #H bond donors: 0
    #Freely Rotating Bonds: 8
    #Rule of 5 Violations: 2
    ACD/LogP: 9.50
    ACD/LogD (pH 5.5): 4.94
    ACD/BCF (pH 5.5): 617.31
    ACD/KOC (pH 5.5): 467.05
    ACD/LogD (pH 7.4): 5.84
    ACD/BCF (pH 7.4): 4853.58
    ACD/KOC (pH 7.4): 3672.19
    Polar Surface Area: 12 Å2
    Polarizability: 55.0±0.5 10-24cm3
    Surface Tension: 45.3±3.0 dyne/cm
    Molar Volume: 393.8±3.0 cm3

    Click to predict properties on the Chemicalize site


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