ChemSpider 2D Image | 3-Bromo-2-fluoro-6-(trifluoromethyl)phenol | C7H3BrF4O

3-Bromo-2-fluoro-6-(trifluoromethyl)phenol

  • Molecular FormulaC7H3BrF4O
  • Average mass258.996 Da
  • Monoisotopic mass257.930328 Da
  • ChemSpider ID30784249

More details:

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

3-Brom-2-fluor-6-(trifluormethyl)phenol [German] [ACD/IUPAC Name]
3-Bromo-2-fluoro-6-(trifluoromethyl)phenol [ACD/IUPAC Name]
3-Bromo-2-fluoro-6-(trifluorométhyl)phénol [French] [ACD/IUPAC Name]
Phenol, 3-bromo-2-fluoro-6-(trifluoromethyl)- [ACD/Index Name]
[943833-04-3] [RN]
943833-04-3 [RN]
MFCD19105352

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

    Density: 1.8±0.1 g/cm3
    Boiling Point: 206.0±35.0 °C at 760 mmHg
    Vapour Pressure: 0.2±0.4 mmHg at 25°C
    Enthalpy of Vaporization: 46.0±3.0 kJ/mol
    Flash Point: 78.4±25.9 °C
    Index of Refraction: 1.487
    Molar Refractivity: 40.8±0.3 cm3
    #H bond acceptors: 1
    #H bond donors: 1
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 3.55
    ACD/LogD (pH 5.5): 3.30
    ACD/BCF (pH 5.5): 168.12
    ACD/KOC (pH 5.5): 1191.19
    ACD/LogD (pH 7.4): 1.82
    ACD/BCF (pH 7.4): 5.66
    ACD/KOC (pH 7.4): 40.10
    Polar Surface Area: 20 Å2
    Polarizability: 16.2±0.5 10-24cm3
    Surface Tension: 32.0±3.0 dyne/cm
    Molar Volume: 141.8±3.0 cm3

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