ChemSpider 2D Image | (4-Iodophenyl)(phenyl)acetonitrile | C14H10IN

(4-Iodophenyl)(phenyl)acetonitrile

  • Molecular FormulaC14H10IN
  • Average mass319.140 Da
  • Monoisotopic mass318.985779 Da
  • ChemSpider ID29204284

More details:

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

(4-Iodophenyl)(phenyl)acetonitrile [ACD/IUPAC Name]
(4-Iodophényl)(phényl)acétonitrile [French] [ACD/IUPAC Name]
(4-Iodphenyl)(phenyl)acetonitril [German] [ACD/IUPAC Name]
Benzeneacetonitrile, 4-iodo-α-phenyl- [ACD/Index Name]
1247026-31-8 [RN]
2-(4-iodophenyl)-2-phenylacetonitrile
MFCD24849133 [MDL number]

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

    Density: 1.6±0.1 g/cm3
    Boiling Point: 378.6±30.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 62.6±3.0 kJ/mol
    Flash Point: 182.8±24.6 °C
    Index of Refraction: 1.645
    Molar Refractivity: 73.0±0.3 cm3
    #H bond acceptors: 1
    #H bond donors: 0
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 4.33
    ACD/LogD (pH 5.5): 4.14
    ACD/BCF (pH 5.5): 828.79
    ACD/KOC (pH 5.5): 4271.92
    ACD/LogD (pH 7.4): 4.14
    ACD/BCF (pH 7.4): 828.79
    ACD/KOC (pH 7.4): 4271.92
    Polar Surface Area: 24 Å2
    Polarizability: 28.9±0.5 10-24cm3
    Surface Tension: 51.8±3.0 dyne/cm
    Molar Volume: 201.5±3.0 cm3

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