ChemSpider 2D Image | 1,1,1-Trifluoro-5-methoxy-2-pentanone | C6H9F3O2

1,1,1-Trifluoro-5-methoxy-2-pentanone

  • Molecular FormulaC6H9F3O2
  • Average mass170.130 Da
  • Monoisotopic mass170.055466 Da
  • ChemSpider ID21521939

More details:

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

1,1,1-Trifluor-5-methoxy-2-pentanon [German] [ACD/IUPAC Name]
1,1,1-Trifluoro-5-methoxy-2-pentanone [ACD/IUPAC Name]
1,1,1-Trifluoro-5-méthoxy-2-pentanone [French] [ACD/IUPAC Name]
1,1,1-TRIFLUORO-5-METHOXYPENTAN-2-ONE
2-Pentanone, 1,1,1-trifluoro-5-methoxy- [ACD/Index Name]
69243-10-3 [RN]
1,1,1-Trifluoro-5-methoxy-pentan-2-one
MFCD08447565

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 140.4±40.0 °C at 760 mmHg
    Vapour Pressure: 6.2±0.3 mmHg at 25°C
    Enthalpy of Vaporization: 37.8±3.0 kJ/mol
    Flash Point: 38.4±22.2 °C
    Index of Refraction: 1.354
    Molar Refractivity: 32.1±0.3 cm3
    #H bond acceptors: 2
    #H bond donors: 0
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 0.72
    ACD/LogD (pH 5.5): 1.03
    ACD/BCF (pH 5.5): 3.59
    ACD/KOC (pH 5.5): 86.83
    ACD/LogD (pH 7.4): 1.03
    ACD/BCF (pH 7.4): 3.59
    ACD/KOC (pH 7.4): 86.83
    Polar Surface Area: 26 Å2
    Polarizability: 12.7±0.5 10-24cm3
    Surface Tension: 22.0±3.0 dyne/cm
    Molar Volume: 147.4±3.0 cm3

    Click to predict properties on the Chemicalize site


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