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Search term: MF = 'C_{9}H_{6}BrF_{3}O_{3}'
ChemSpider 2D Image | [5-Bromo-2-(trifluoromethoxy)phenyl]acetic acid | C9H6BrF3O3

[5-Bromo-2-(trifluoromethoxy)phenyl]acetic acid

  • Molecular FormulaC9H6BrF3O3
  • Average mass299.041 Da
  • Monoisotopic mass297.945221 Da
  • ChemSpider ID57385040

More details:

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

[5-Brom-2-(trifluormethoxy)phenyl]essigsäure [German] [ACD/IUPAC Name]
[5-Bromo-2-(trifluoromethoxy)phenyl]acetic acid [ACD/IUPAC Name]
Acide [5-bromo-2-(trifluorométhoxy)phényl]acétique [French] [ACD/IUPAC Name]
Benzeneacetic acid, 5-bromo-2-(trifluoromethoxy)- [ACD/Index Name]
1956327-16-4 [RN]
2-(5-Bromo-2-(trifluoromethoxy)phenyl)acetic acid
2-[5-Bromo-2-(trifluoromethoxy)phenyl]acetic acid
5-BROMO-2-(TRIFLUOROMETHOXY)PHENYLACETIC ACID
MFCD29920603

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

    Density: 1.7±0.1 g/cm3
    Boiling Point: 309.1±37.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 58.1±3.0 kJ/mol
    Flash Point: 140.7±26.5 °C
    Index of Refraction: 1.514
    Molar Refractivity: 52.2±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 1
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 3.49
    ACD/LogD (pH 5.5): 1.64
    ACD/BCF (pH 5.5): 4.11
    ACD/KOC (pH 5.5): 32.19
    ACD/LogD (pH 7.4): -0.04
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 47 Å2
    Polarizability: 20.7±0.5 10-24cm3
    Surface Tension: 40.1±3.0 dyne/cm
    Molar Volume: 173.5±3.0 cm3

    Click to predict properties on the Chemicalize site


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