ChemSpider 2D Image | MFCD07369913 | C9H10BrNO

MFCD07369913

  • Molecular FormulaC9H10BrNO
  • Average mass228.086 Da
  • Monoisotopic mass226.994568 Da
  • ChemSpider ID21373642

More details:

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

4-Brom-3,5-dimethylbenzamid [German] [ACD/IUPAC Name]
4-Bromo-3,5-dimethylbenzamide [ACD/IUPAC Name]
4-Bromo-3,5-dimethyl-benzamide
4-Bromo-3,5-diméthylbenzamide [French] [ACD/IUPAC Name]
864825-81-0 [RN]
Benzamide, 4-bromo-3,5-dimethyl- [ACD/Index Name]
MFCD07369913
[864825-81-0] [RN]
2-(2-Bromoethyl)pyridine HBr
4-Bromo-3,5-Dimethylbenzamide (en)
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 4693 [DBID]
MFCD08274972 [DBID]

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

    Density: 1.5±0.1 g/cm3
    Boiling Point: 261.1±40.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.5 mmHg at 25°C
    Enthalpy of Vaporization: 49.9±3.0 kJ/mol
    Flash Point: 111.7±27.3 °C
    Index of Refraction: 1.584
    Molar Refractivity: 52.5±0.3 cm3
    #H bond acceptors: 2
    #H bond donors: 2
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 2.68
    ACD/LogD (pH 5.5): 2.58
    ACD/BCF (pH 5.5): 53.93
    ACD/KOC (pH 5.5): 604.31
    ACD/LogD (pH 7.4): 2.58
    ACD/BCF (pH 7.4): 53.93
    ACD/KOC (pH 7.4): 604.31
    Polar Surface Area: 43 Å2
    Polarizability: 20.8±0.5 10-24cm3
    Surface Tension: 45.5±3.0 dyne/cm
    Molar Volume: 156.9±3.0 cm3

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