ChemSpider 2D Image | 1-(5-Fluoro-2-methylphenyl)cyclobutanecarbonitrile | C12H12FN

1-(5-Fluoro-2-methylphenyl)cyclobutanecarbonitrile

  • Molecular FormulaC12H12FN
  • Average mass189.229 Da
  • Monoisotopic mass189.095383 Da
  • ChemSpider ID60743231

More details:

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

1-(5-Fluor-2-methylphenyl)cyclobutancarbonitril [German] [ACD/IUPAC Name]
1-(5-Fluoro-2-methylphenyl)cyclobutanecarbonitrile [ACD/IUPAC Name]
1-(5-Fluoro-2-méthylphényl)cyclobutanecarbonitrile [French] [ACD/IUPAC Name]
Cyclobutanecarbonitrile, 1-(5-fluoro-2-methylphenyl)- [ACD/Index Name]
1-(5-fluoro-2-methylphenyl)cyclobutane-1-carbonitrile
1314772-57-0 [RN]
MFCD19697446

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

    Density: 1.1±0.1 g/cm3
    Boiling Point: 309.6±37.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 55.0±3.0 kJ/mol
    Flash Point: 132.6±30.2 °C
    Index of Refraction: 1.536
    Molar Refractivity: 52.5±0.4 cm3
    #H bond acceptors: 1
    #H bond donors: 0
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 2.61
    ACD/LogD (pH 5.5): 2.79
    ACD/BCF (pH 5.5): 78.13
    ACD/KOC (pH 5.5): 787.93
    ACD/LogD (pH 7.4): 2.79
    ACD/BCF (pH 7.4): 78.13
    ACD/KOC (pH 7.4): 787.93
    Polar Surface Area: 24 Å2
    Polarizability: 20.8±0.5 10-24cm3
    Surface Tension: 40.8±5.0 dyne/cm
    Molar Volume: 168.4±5.0 cm3

    Click to predict properties on the Chemicalize site


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