ChemSpider 2D Image | [2,2,2-Trifluoro-1-(3-fluorophenyl)ethoxy]acetic acid | C10H8F4O3

[2,2,2-Trifluoro-1-(3-fluorophenyl)ethoxy]acetic acid

  • Molecular FormulaC10H8F4O3
  • Average mass252.162 Da
  • Monoisotopic mass252.040955 Da
  • ChemSpider ID35489942

More details:

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

[2,2,2-Trifluor-1-(3-fluorphenyl)ethoxy]essigsäure [German] [ACD/IUPAC Name]
[2,2,2-Trifluoro-1-(3-fluorophenyl)ethoxy]acetic acid [ACD/IUPAC Name]
Acetic acid, 2-[2,2,2-trifluoro-1-(3-fluorophenyl)ethoxy]- [ACD/Index Name]
Acide [2,2,2-trifluoro-1-(3-fluorophényl)éthoxy]acétique [French] [ACD/IUPAC Name]
[2,2,2-Trifluoro-1-(3-fluoro-phenyl)-ethoxy]-acetic acid
1437432-67-1 [RN]
2-(2,2,2-Trifluoro-1-(3-fluorophenyl)ethoxy)acetic acid
2-[2,2,2-trifluoro-1-(3-fluorophenyl)ethoxy]acetic acid
MFCD24683224

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 316.3±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 58.9±3.0 kJ/mol
    Flash Point: 145.1±27.9 °C
    Index of Refraction: 1.462
    Molar Refractivity: 48.8±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 1
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 2.74
    ACD/LogD (pH 5.5): -0.16
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.45
    ACD/LogD (pH 7.4): -1.35
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 47 Å2
    Polarizability: 19.4±0.5 10-24cm3
    Surface Tension: 35.8±3.0 dyne/cm
    Molar Volume: 177.6±3.0 cm3

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