Found 30 results

Search term: MF = 'C_{4}H_{5}F_{3}O_{3}'

ChemSpider 2D Image | 3-(Trifluoromethoxy)propanoic acid | C4H5F3O3

3-(Trifluoromethoxy)propanoic acid

  • Molecular FormulaC4H5F3O3
  • Average mass158.076 Da
  • Monoisotopic mass158.019073 Da
  • ChemSpider ID48492483

More details:






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

3-(Trifluormethoxy)propansäure [German] [ACD/IUPAC Name]
3-(Trifluoromethoxy)propanoic acid [ACD/IUPAC Name]
Acide 3-(trifluorométhoxy)propanoïque [French] [ACD/IUPAC Name]
Propanoic acid, 3-(trifluoromethoxy)- [ACD/Index Name]
1483237-81-5 [RN]
95%
MFCD16617762

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 138.6±40.0 °C at 760 mmHg
    Vapour Pressure: 3.9±0.5 mmHg at 25°C
    Enthalpy of Vaporization: 41.5±6.0 kJ/mol
    Flash Point: 37.6±27.3 °C
    Index of Refraction: 1.354
    Molar Refractivity: 24.3±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 1
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 1.17
    ACD/LogD (pH 5.5): -0.99
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.27
    ACD/LogD (pH 7.4): -2.68
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 47 Å2
    Polarizability: 9.7±0.5 10-24cm3
    Surface Tension: 27.5±3.0 dyne/cm
    Molar Volume: 111.9±3.0 cm3

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