ChemSpider 2D Image | 8-Bromo-6-fluorochroman-4-one | C9H6BrFO2

8-Bromo-6-fluorochroman-4-one

  • Molecular FormulaC9H6BrFO2
  • Average mass245.045 Da
  • Monoisotopic mass243.953506 Da
  • ChemSpider ID38091937

More details:

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

1092350-87-2 [RN]
4H-1-Benzopyran-4-one, 8-bromo-6-fluoro-2,3-dihydro- [ACD/Index Name]
8-Brom-6-fluor-2,3-dihydro-4H-chromen-4-on [German] [ACD/IUPAC Name]
8-Bromo-6-fluoro-2,3-dihydro-4H-chromen-4-one [ACD/IUPAC Name]
8-Bromo-6-fluoro-2,3-dihydro-4H-chromén-4-one [French] [ACD/IUPAC Name]
8-Bromo-6-fluorochroman-4-one
8-bromo-6-fluoro-2,3-dihydro-1-benzopyran-4-one
8-bromo-6-fluoro-3,4-dihydro-2H-1-benzopyran-4-one
DS-8148
MFCD11104781

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

    Density: 1.7±0.1 g/cm3
    Boiling Point: 344.8±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 58.9±3.0 kJ/mol
    Flash Point: 162.3±27.9 °C
    Index of Refraction: 1.578
    Molar Refractivity: 47.8±0.3 cm3
    #H bond acceptors: 2
    #H bond donors: 0
    #Freely Rotating Bonds: 0
    #Rule of 5 Violations: 0
    ACD/LogP: 2.87
    ACD/LogD (pH 5.5): 2.66
    ACD/BCF (pH 5.5): 62.35
    ACD/KOC (pH 5.5): 670.43
    ACD/LogD (pH 7.4): 2.66
    ACD/BCF (pH 7.4): 62.35
    ACD/KOC (pH 7.4): 670.43
    Polar Surface Area: 26 Å2
    Polarizability: 19.0±0.5 10-24cm3
    Surface Tension: 46.4±3.0 dyne/cm
    Molar Volume: 144.2±3.0 cm3

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