ChemSpider 2D Image | 5-Bromo-4-chloronicotinonitrile | C6H2BrClN2

5-Bromo-4-chloronicotinonitrile

  • Molecular FormulaC6H2BrClN2
  • Average mass217.451 Da
  • Monoisotopic mass215.908981 Da
  • ChemSpider ID29339813

More details:

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

1160923-98-7 [RN]
3-Pyridinecarbonitrile, 5-bromo-4-chloro- [ACD/Index Name]
5-Brom-4-chlornicotinonitril [German] [ACD/IUPAC Name]
5-Bromo-4-chloronicotinonitrile [ACD/IUPAC Name]
5-Bromo-4-chloronicotinonitrile [French] [ACD/IUPAC Name]
5-Bromo-4-chloro-nicotinonitrile
5-bromo-4-chloropyridine-3-carbonitrile
95%
AGN-PC-0HY2GL
AJ-134054
More...

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

    Density: 1.9±0.1 g/cm3
    Boiling Point: 271.9±35.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.6 mmHg at 25°C
    Enthalpy of Vaporization: 51.0±3.0 kJ/mol
    Flash Point: 118.2±25.9 °C
    Index of Refraction: 1.629
    Molar Refractivity: 41.7±0.4 cm3
    #H bond acceptors: 2
    #H bond donors: 0
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 1.56
    ACD/LogD (pH 5.5): 2.01
    ACD/BCF (pH 5.5): 19.84
    ACD/KOC (pH 5.5): 295.38
    ACD/LogD (pH 7.4): 2.01
    ACD/BCF (pH 7.4): 19.84
    ACD/KOC (pH 7.4): 295.39
    Polar Surface Area: 37 Å2
    Polarizability: 16.5±0.5 10-24cm3
    Surface Tension: 68.0±5.0 dyne/cm
    Molar Volume: 117.3±5.0 cm3

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