ChemSpider 2D Image | Methyl 3,3,3-trifluoro-2,2-dimethylpropanoate | C6H9F3O2

Methyl 3,3,3-trifluoro-2,2-dimethylpropanoate

  • Molecular FormulaC6H9F3O2
  • Average mass170.130 Da
  • Monoisotopic mass170.055466 Da
  • ChemSpider ID26235306

More details:

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

1188911-72-9 [RN]
3,3,3-Trifluoro-2,2-diméthylpropanoate de méthyle [French] [ACD/IUPAC Name]
Methyl 3,3,3-trifluoro-2,2-dimethylpropanoate [ACD/IUPAC Name]
Methyl-3,3,3-trifluorpivalat [German] [ACD/IUPAC Name]
Propanoic acid, 3,3,3-trifluoro-2,2-dimethyl-, methyl ester [ACD/Index Name]
(2S,3R)-2-(2,4-Difluorophenyl)-3-(5-fluoropyrimidin-4-yl)-1-(1H-1,2,4-triazol-1-yl)butan-2-ol
[1188911-72-9] [RN]
3,3,3-Trifluoro-2,2-dimethylpropionic acid methyl ester
3,3,3-Trifluoro-2,2-dimethyl-propionic acid methyl ester
3,3,3-trifluoro-2,2-dimethylpropionic acid methylester
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 4693 [DBID]

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 113.8±35.0 °C at 760 mmHg
    Vapour Pressure: 20.4±0.2 mmHg at 25°C
    Enthalpy of Vaporization: 35.2±3.0 kJ/mol
    Flash Point: 7.0±18.2 °C
    Index of Refraction: 1.354
    Molar Refractivity: 32.0±0.3 cm3
    #H bond acceptors: 2
    #H bond donors: 0
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 1.34
    ACD/LogD (pH 5.5): 1.79
    ACD/BCF (pH 5.5): 13.57
    ACD/KOC (pH 5.5): 225.10
    ACD/LogD (pH 7.4): 1.79
    ACD/BCF (pH 7.4): 13.57
    ACD/KOC (pH 7.4): 225.10
    Polar Surface Area: 26 Å2
    Polarizability: 12.7±0.5 10-24cm3
    Surface Tension: 20.6±3.0 dyne/cm
    Molar Volume: 147.5±3.0 cm3

    Click to predict properties on the Chemicalize site


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