ChemSpider 2D Image | 1-[(2-Fluorophenyl)(4-fluorophenyl)methyl]-4-[(2E)-3-phenyl-2-propen-1-yl]piperazine | C26H26F2N2

1-[(2-Fluorophenyl)(4-fluorophenyl)methyl]-4-[(2E)-3-phenyl-2-propen-1-yl]piperazine

  • Molecular FormulaC26H26F2N2
  • Average mass404.495 Da
  • Monoisotopic mass404.206390 Da
  • ChemSpider ID48057633
  • Double-bond stereo - Double-bond stereo


More details:






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

1-[(2-Fluorophenyl)(4-fluorophenyl)methyl]-4-[(2E)-3-phenyl-2-propen-1-yl]piperazine [ACD/IUPAC Name]
1-[(2-Fluorophényl)(4-fluorophényl)méthyl]-4-[(2E)-3-phényl-2-propén-1-yl]pipérazine [French] [ACD/IUPAC Name]
1-[(2-Fluorphenyl)(4-fluorphenyl)methyl]-4-[(2E)-3-phenyl-2-propen-1-yl]piperazin [German] [ACD/IUPAC Name]
Piperazine, 1-[(2-fluorophenyl)(4-fluorophenyl)methyl]-4-[(2E)-3-phenyl-2-propen-1-yl]- [ACD/Index Name]
1663-45-2 [RN]
4-Defluoro 2-Fluoro Flunarizine
90830-31-2 [RN]

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 507.9±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.3 mmHg at 25°C
    Enthalpy of Vaporization: 77.8±3.0 kJ/mol
    Flash Point: 260.9±30.1 °C
    Index of Refraction: 1.607
    Molar Refractivity: 119.3±0.3 cm3
    #H bond acceptors: 2
    #H bond donors: 0
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 0
    ACD/LogP: 4.74
    ACD/LogD (pH 5.5): 3.37
    ACD/BCF (pH 5.5): 96.20
    ACD/KOC (pH 5.5): 352.52
    ACD/LogD (pH 7.4): 4.70
    ACD/BCF (pH 7.4): 2031.07
    ACD/KOC (pH 7.4): 7442.90
    Polar Surface Area: 6 Å2
    Polarizability: 47.3±0.5 10-24cm3
    Surface Tension: 45.1±3.0 dyne/cm
    Molar Volume: 345.6±3.0 cm3

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