ChemSpider 2D Image | 3-[5-Bromo-2-(difluoromethoxy)phenyl]propanoic acid | C10H9BrF2O3

3-[5-Bromo-2-(difluoromethoxy)phenyl]propanoic acid

  • Molecular FormulaC10H9BrF2O3
  • Average mass295.078 Da
  • Monoisotopic mass293.970306 Da
  • ChemSpider ID25083708

More details:

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

3-[5-Brom-2-(difluormethoxy)phenyl]propansäure [German] [ACD/IUPAC Name]
3-[5-Bromo-2-(difluoromethoxy)phenyl]propanoic acid [ACD/IUPAC Name]
Acide 3-[5-bromo-2-(difluorométhoxy)phényl]propanoïque [French] [ACD/IUPAC Name]
Benzenepropanoic acid, 5-bromo-2-(difluoromethoxy)- [ACD/Index Name]
1086386-07-3 [RN]
3-(5-Bromo-2-(difluoromethoxy)phenyl)propanoic acid
3-(5-bromo-2-(difluoromethoxy)phenyl)propionic acid
3-(5'-Bromo-2'-(difluoromethoxy)phenyl)propionic acid
AKOS015957332
BENZENEPROPANOICACID, 5-BROMO-2-(DIFLUOROMETHOXY)-
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.6±0.1 g/cm3
    Boiling Point: 359.0±37.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 63.8±3.0 kJ/mol
    Flash Point: 170.9±26.5 °C
    Index of Refraction: 1.525
    Molar Refractivity: 56.7±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 1
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 2.97
    ACD/LogD (pH 5.5): 1.81
    ACD/BCF (pH 5.5): 7.98
    ACD/KOC (pH 5.5): 79.76
    ACD/LogD (pH 7.4): 0.00
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.25
    Polar Surface Area: 47 Å2
    Polarizability: 22.5±0.5 10-24cm3
    Surface Tension: 41.5±3.0 dyne/cm
    Molar Volume: 184.8±3.0 cm3

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