ChemSpider 2D Image | 4-Bromo-6-fluoronicotinonitrile | C6H2BrFN2

4-Bromo-6-fluoronicotinonitrile

  • Molecular FormulaC6H2BrFN2
  • Average mass200.996 Da
  • Monoisotopic mass199.938538 Da
  • ChemSpider ID57325494

More details:

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

1805591-30-3 [RN]
3-Pyridinecarbonitrile, 4-bromo-6-fluoro- [ACD/Index Name]
4-Brom-6-fluornicotinonitril [German] [ACD/IUPAC Name]
4-Bromo-6-fluoronicotinonitrile [ACD/IUPAC Name]
4-Bromo-6-fluoronicotinonitrile [French] [ACD/IUPAC Name]
4-bromo-6-fluoropyridine-3-carbonitrile
MFCD28735382

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

    Density: 1.8±0.1 g/cm3
    Boiling Point: 301.4±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.6 mmHg at 25°C
    Enthalpy of Vaporization: 54.2±3.0 kJ/mol
    Flash Point: 136.1±27.9 °C
    Index of Refraction: 1.581
    Molar Refractivity: 37.0±0.4 cm3
    #H bond acceptors: 2
    #H bond donors: 0
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 1.21
    ACD/LogD (pH 5.5): 1.26
    ACD/BCF (pH 5.5): 5.39
    ACD/KOC (pH 5.5): 116.26
    ACD/LogD (pH 7.4): 1.26
    ACD/BCF (pH 7.4): 5.39
    ACD/KOC (pH 7.4): 116.26
    Polar Surface Area: 37 Å2
    Polarizability: 14.6±0.5 10-24cm3
    Surface Tension: 58.7±5.0 dyne/cm
    Molar Volume: 110.9±5.0 cm3

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