ChemSpider 2D Image | 7-Bromo-4-(trifluoromethyl)quinolin-2(1H)-one | C10H5BrF3NO

7-Bromo-4-(trifluoromethyl)quinolin-2(1H)-one

  • Molecular FormulaC10H5BrF3NO
  • Average mass292.052 Da
  • Monoisotopic mass290.950653 Da
  • ChemSpider ID24598909

More details:

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

7-Bromo-4-(trifluoromethyl)quinolin-2(1H)-one
847900-73-6 [RN]
7-bromo-4-(trifluoromethyl)-1H-quinolin-2-one
7-Bromo-4-(trifluoromethyl)-2(1H)-quinolinone [ACD/IUPAC Name]
MFCD12756520 [MDL number]

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: 1.7±0.1 g/cm3
    Boiling Point: 319.2±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 56.1±3.0 kJ/mol
    Flash Point: 146.8±27.9 °C
    Index of Refraction: 1.550
    Molar Refractivity: 54.0±0.3 cm3
    #H bond acceptors: 2
    #H bond donors: 1
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 3.69
    ACD/LogD (pH 5.5): 3.35
    ACD/BCF (pH 5.5): 208.42
    ACD/KOC (pH 5.5): 1590.37
    ACD/LogD (pH 7.4): 3.35
    ACD/BCF (pH 7.4): 207.29
    ACD/KOC (pH 7.4): 1581.72
    Polar Surface Area: 29 Å2
    Polarizability: 21.4±0.5 10-24cm3
    Surface Tension: 39.6±3.0 dyne/cm
    Molar Volume: 169.3±3.0 cm3

    Click to predict properties on the Chemicalize site


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