ChemSpider 2D Image | (4-Bromo-2,6-dimethylphenyl)boronic acid | C8H10BBrO2

(4-Bromo-2,6-dimethylphenyl)boronic acid

  • Molecular FormulaC8H10BBrO2
  • Average mass228.879 Da
  • Monoisotopic mass227.995712 Da
  • ChemSpider ID29738416

More details:

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

(4-Brom-2,6-dimethylphenyl)borsäure [German] [ACD/IUPAC Name]
(4-Bromo-2,6-dimethylphenyl)boronic acid [ACD/IUPAC Name]
1160561-24-9 [RN]
Acide (4-bromo-2,6-diméthylphényl)boronique [French] [ACD/IUPAC Name]
Boronic acid, B-(4-bromo-2,6-dimethylphenyl)- [ACD/Index Name]
(4-Bromo-2,6-dimethyl-phenyl)boronic acid
[1160561-24-9] [RN]
4-Bromo-2,6-dimethylphenylboronic acid
4-Bromo-2,6-dimethylphenylboronicacid
MFCD13181651

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

    Density: 1.5±0.1 g/cm3
    Boiling Point: 346.6±52.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 62.4±3.0 kJ/mol
    Flash Point: 163.4±30.7 °C
    Index of Refraction: 1.574
    Molar Refractivity: 50.3±0.4 cm3
    #H bond acceptors: 2
    #H bond donors: 2
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 3.28
    ACD/LogD (pH 5.5): 2.95
    ACD/BCF (pH 5.5): 102.27
    ACD/KOC (pH 5.5): 955.12
    ACD/LogD (pH 7.4): 2.91
    ACD/BCF (pH 7.4): 94.40
    ACD/KOC (pH 7.4): 881.67
    Polar Surface Area: 40 Å2
    Polarizability: 19.9±0.5 10-24cm3
    Surface Tension: 47.3±5.0 dyne/cm
    Molar Volume: 152.3±5.0 cm3

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