ChemSpider 2D Image | 6-(4-Iodophenyl)-4-pyrimidinecarbonitrile | C11H6IN3

6-(4-Iodophenyl)-4-pyrimidinecarbonitrile

  • Molecular FormulaC11H6IN3
  • Average mass307.090 Da
  • Monoisotopic mass306.960632 Da
  • ChemSpider ID58224789

More details:

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

4-Pyrimidinecarbonitrile, 6-(4-iodophenyl)- [ACD/Index Name]
6-(4-Iodophenyl)-4-pyrimidinecarbonitrile [ACD/IUPAC Name]
6-(4-Iodophényl)-4-pyrimidinecarbonitrile [French] [ACD/IUPAC Name]
6-(4-Iodphenyl)-4-pyrimidincarbonitril [German] [ACD/IUPAC Name]
2092515-86-9 [RN]
6-(4-iodophenyl)pyrimidine-4-carbonitrile
MFCD30001132

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

    Density: 1.9±0.1 g/cm3
    Boiling Point: 423.5±40.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 67.8±3.0 kJ/mol
    Flash Point: 209.9±27.3 °C
    Index of Refraction: 1.708
    Molar Refractivity: 64.5±0.4 cm3
    #H bond acceptors: 3
    #H bond donors: 0
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 3.82
    ACD/LogD (pH 5.5): 2.30
    ACD/BCF (pH 5.5): 32.93
    ACD/KOC (pH 5.5): 424.51
    ACD/LogD (pH 7.4): 2.30
    ACD/BCF (pH 7.4): 32.93
    ACD/KOC (pH 7.4): 424.51
    Polar Surface Area: 50 Å2
    Polarizability: 25.6±0.5 10-24cm3
    Surface Tension: 76.7±5.0 dyne/cm
    Molar Volume: 165.6±5.0 cm3

    Click to predict properties on the Chemicalize site


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