ChemSpider 2D Image | 2,4-Dibromo-6-fluorobenzonitrile | C7H2Br2FN

2,4-Dibromo-6-fluorobenzonitrile

  • Molecular FormulaC7H2Br2FN
  • Average mass278.904 Da
  • Monoisotopic mass276.853790 Da
  • ChemSpider ID27475305

More details:

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

2,4-Dibrom-6-fluorbenzonitril [German] [ACD/IUPAC Name]
2,4-Dibromo-6-fluorobenzonitrile [ACD/IUPAC Name]
2,4-Dibromo-6-fluorobenzonitrile [French] [ACD/IUPAC Name]
Benzonitrile, 2,4-dibromo-6-fluoro- [ACD/Index Name]
(1,4-Dioxa-spiro4.5dec-8-ylidene)-acetonitrile
[1393585-66-4] [RN]
124499-35-0 [RN]
1393585-66-4 [RN]
2,4-DIBROMO-6-FLUORO-BENZONITRILE
benzonitrile, 2,​4-​dibromo-​6-​fluoro-
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 4693 [DBID]

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

    Density: 2.1±0.1 g/cm3
    Boiling Point: 293.4±40.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.6 mmHg at 25°C
    Enthalpy of Vaporization: 53.3±3.0 kJ/mol
    Flash Point: 131.3±27.3 °C
    Index of Refraction: 1.634
    Molar Refractivity: 46.9±0.4 cm3
    #H bond acceptors: 1
    #H bond donors: 0
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 2.77
    ACD/LogD (pH 5.5): 3.45
    ACD/BCF (pH 5.5): 248.85
    ACD/KOC (pH 5.5): 1805.58
    ACD/LogD (pH 7.4): 3.45
    ACD/BCF (pH 7.4): 248.85
    ACD/KOC (pH 7.4): 1805.58
    Polar Surface Area: 24 Å2
    Polarizability: 18.6±0.5 10-24cm3
    Surface Tension: 58.4±5.0 dyne/cm
    Molar Volume: 131.1±5.0 cm3

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