ChemSpider 2D Image | 2-Bromo-6-methoxybenzonitrile | C8H6BrNO

2-Bromo-6-methoxybenzonitrile

  • Molecular FormulaC8H6BrNO
  • Average mass212.043 Da
  • Monoisotopic mass210.963272 Da
  • ChemSpider ID24748506

More details:

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

1245647-50-0 [RN]
2-Brom-6-methoxybenzonitril [German] [ACD/IUPAC Name]
2-Bromo-6-methoxybenzonitrile [ACD/IUPAC Name]
2-Bromo-6-méthoxybenzonitrile [French] [ACD/IUPAC Name]
Benzonitrile, 2-bromo-6-methoxy- [ACD/Index Name]
[1245647-50-0] [RN]
2-bromo-6-methoxy-benzonitrile
2-BROMO-6-METHOXYBENZONITRILE|2-BROMO-6-METHOXYBENZONITRILE
3-bromo-2-cyanoanisole
4-(pyrrolidin-1-yl)butan-2-amine
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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: 1.6±0.1 g/cm3
    Boiling Point: 310.9±27.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 55.2±3.0 kJ/mol
    Flash Point: 141.8±23.7 °C
    Index of Refraction: 1.584
    Molar Refractivity: 45.4±0.4 cm3
    #H bond acceptors: 2
    #H bond donors: 0
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 2.56
    ACD/LogD (pH 5.5): 2.83
    ACD/BCF (pH 5.5): 83.18
    ACD/KOC (pH 5.5): 824.07
    ACD/LogD (pH 7.4): 2.83
    ACD/BCF (pH 7.4): 83.18
    ACD/KOC (pH 7.4): 824.07
    Polar Surface Area: 33 Å2
    Polarizability: 18.0±0.5 10-24cm3
    Surface Tension: 51.1±5.0 dyne/cm
    Molar Volume: 135.6±5.0 cm3

    Click to predict properties on the Chemicalize site


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