ChemSpider 2D Image | N-(3-Bromo-4-oxocyclohexyl)acetamide | C8H12BrNO2

N-(3-Bromo-4-oxocyclohexyl)acetamide

  • Molecular FormulaC8H12BrNO2
  • Average mass234.090 Da
  • Monoisotopic mass233.005127 Da
  • ChemSpider ID28581126

More details:

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

687639-03-8 [RN]
Acetamide, N-(3-bromo-4-oxocyclohexyl)- [ACD/Index Name]
N-(3-Brom-4-oxocyclohexyl)acetamid [German] [ACD/IUPAC Name]
N-(3-Bromo-4-oxocyclohexyl)acetamide [ACD/IUPAC Name]
N-(3-Bromo-4-oxocyclohexyl)acétamide [French] [ACD/IUPAC Name]
MFCD24386973 [MDL number]

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

    Density: 1.5±0.1 g/cm3
    Boiling Point: 402.0±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 65.3±3.0 kJ/mol
    Flash Point: 196.9±28.7 °C
    Index of Refraction: 1.523
    Molar Refractivity: 48.6±0.4 cm3
    #H bond acceptors: 3
    #H bond donors: 1
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: -0.52
    ACD/LogD (pH 5.5): -0.03
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 23.06
    ACD/LogD (pH 7.4): -0.03
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 23.06
    Polar Surface Area: 46 Å2
    Polarizability: 19.3±0.5 10-24cm3
    Surface Tension: 43.4±5.0 dyne/cm
    Molar Volume: 159.1±5.0 cm3

    Click to predict properties on the Chemicalize site


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