ChemSpider 2D Image | 7-Bromo-1,3,4,5-tetrahydro-2H-1-benzazepin-2-one | C10H10BrNO

7-Bromo-1,3,4,5-tetrahydro-2H-1-benzazepin-2-one

  • Molecular FormulaC10H10BrNO
  • Average mass240.096 Da
  • Monoisotopic mass238.994568 Da
  • ChemSpider ID23078352

More details:

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

2H-1-Benzazepin-2-one, 7-bromo-1,3,4,5-tetrahydro- [ACD/Index Name]
53841-99-9 [RN]
7-Brom-1,3,4,5-tetrahydro-2H-1-benzazepin-2-on [German] [ACD/IUPAC Name]
7-Bromo-1,3,4,5-tetrahydro-2H-1-benzazepin-2-one [ACD/IUPAC Name]
7-Bromo-1,3,4,5-tétrahydro-2H-1-benzazépin-2-one [French] [ACD/IUPAC Name]
[53841-99-9] [RN]
2H-1-Benzazepin-2-one,7-bromo-1,3,4,5-tetrahydro-
7-Brom-1,3,4,5-tetrahydro-2H-benzazepin-2-on
7-bromo-1,3,4,5-tetrahydro-1-benzazepin-2-one
7-bromo-1,3,4,5-tetrahydro-2H-benzo[b]azepin-2-one
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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: 1.5±0.1 g/cm3
    Boiling Point: 385.8±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 63.5±3.0 kJ/mol
    Flash Point: 187.1±27.9 °C
    Index of Refraction: 1.581
    Molar Refractivity: 54.2±0.3 cm3
    #H bond acceptors: 2
    #H bond donors: 1
    #Freely Rotating Bonds: 0
    #Rule of 5 Violations: 0
    ACD/LogP: 3.05
    ACD/LogD (pH 5.5): 2.91
    ACD/BCF (pH 5.5): 95.74
    ACD/KOC (pH 5.5): 911.32
    ACD/LogD (pH 7.4): 2.91
    ACD/BCF (pH 7.4): 95.74
    ACD/KOC (pH 7.4): 911.33
    Polar Surface Area: 29 Å2
    Polarizability: 21.5±0.5 10-24cm3
    Surface Tension: 43.2±3.0 dyne/cm
    Molar Volume: 162.7±3.0 cm3

    Click to predict properties on the Chemicalize site


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