ChemSpider 2D Image | 1-(3-Bromo-2-fluorophenyl)-1-propanone | C9H8BrFO

1-(3-Bromo-2-fluorophenyl)-1-propanone

  • Molecular FormulaC9H8BrFO
  • Average mass231.062 Da
  • Monoisotopic mass229.974243 Da
  • ChemSpider ID28599826

More details:

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

1-(3-Brom-2-fluorphenyl)-1-propanon [German] [ACD/IUPAC Name]
1-(3-Bromo-2-fluorophenyl)-1-propanone [ACD/IUPAC Name]
1-(3-Bromo-2-fluorophényl)-1-propanone [French] [ACD/IUPAC Name]
1-Propanone, 1-(3-bromo-2-fluorophenyl)- [ACD/Index Name]
[1261680-61-8] [RN]
1-(3-Bromo-2-fluorophenyl)propan-1-one
1261680-61-8 [RN]
3-bromo-2-fluoropropiophenone
3'-Bromo-2'-fluoropropiophenone
MFCD18391369 [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: 268.6±25.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.5 mmHg at 25°C
    Enthalpy of Vaporization: 50.7±3.0 kJ/mol
    Flash Point: 116.3±23.2 °C
    Index of Refraction: 1.528
    Molar Refractivity: 48.6±0.3 cm3
    #H bond acceptors: 1
    #H bond donors: 0
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 2.65
    ACD/LogD (pH 5.5): 2.69
    ACD/BCF (pH 5.5): 65.40
    ACD/KOC (pH 5.5): 693.79
    ACD/LogD (pH 7.4): 2.69
    ACD/BCF (pH 7.4): 65.40
    ACD/KOC (pH 7.4): 693.79
    Polar Surface Area: 17 Å2
    Polarizability: 19.3±0.5 10-24cm3
    Surface Tension: 37.2±3.0 dyne/cm
    Molar Volume: 157.9±3.0 cm3

    Click to predict properties on the Chemicalize site


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