ChemSpider 2D Image | 1-(3-Bromo-4-nitrophenyl)ethanone | C8H6BrNO3

1-(3-Bromo-4-nitrophenyl)ethanone

  • Molecular FormulaC8H6BrNO3
  • Average mass244.042 Da
  • Monoisotopic mass242.953094 Da
  • ChemSpider ID26538083

More details:

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

1-(3-Brom-4-nitrophenyl)ethanon [German] [ACD/IUPAC Name]
1-(3-Bromo-4-nitrophenyl)ethanone [ACD/IUPAC Name]
1-(3-Bromo-4-nitrophényl)éthanone [French] [ACD/IUPAC Name]
Ethanone, 1-(3-bromo-4-nitrophenyl)- [ACD/Index Name]
1-(3-BROMO-4-NITROPHENYL)ETHAN-1-ONE
3-bromo-4-nitroacetophenone
3'-Bromo-4'-nitroacetophenone
56759-33-2 [RN]
AGN-PC-0NI5CD
MFCD18973825

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

    Density: 1.6±0.1 g/cm3
    Boiling Point: 306.4±27.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.6 mmHg at 25°C
    Enthalpy of Vaporization: 54.7±3.0 kJ/mol
    Flash Point: 139.1±23.7 °C
    Index of Refraction: 1.593
    Molar Refractivity: 50.5±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 0
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 2.13
    ACD/LogD (pH 5.5): 2.26
    ACD/BCF (pH 5.5): 30.85
    ACD/KOC (pH 5.5): 405.12
    ACD/LogD (pH 7.4): 2.26
    ACD/BCF (pH 7.4): 30.85
    ACD/KOC (pH 7.4): 405.12
    Polar Surface Area: 63 Å2
    Polarizability: 20.0±0.5 10-24cm3
    Surface Tension: 51.1±3.0 dyne/cm
    Molar Volume: 149.0±3.0 cm3

    Click to predict properties on the Chemicalize site


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