ChemSpider 2D Image | [5-(Trifluoromethyl)-2-pyridinyl]acetonitrile | C8H5F3N2

[5-(Trifluoromethyl)-2-pyridinyl]acetonitrile

  • Molecular FormulaC8H5F3N2
  • Average mass186.134 Da
  • Monoisotopic mass186.040482 Da
  • ChemSpider ID21627288

More details:

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

[5-(Trifluormethyl)-2-pyridinyl]acetonitril [German] [ACD/IUPAC Name]
[5-(Trifluoromethyl)-2-pyridinyl]acetonitrile [ACD/IUPAC Name]
[5-(Trifluorométhyl)-2-pyridinyl]acétonitrile [French] [ACD/IUPAC Name]
[5-(trifluoromethyl)pyridin-2-yl]acetonitrile
2-(5-(Trifluoromethyl)Pyridin-2-Yl)Acetonitrile
2-Pyridineacetonitrile, 5-(trifluoromethyl)- [ACD/Index Name]
939793-18-7 [RN]
(5-[Trifluoromethyl)pyridin-2-yl]acetonitrile
(5-Trifluoromethylpyridin-2-yl)acetonitrile
(5-TRIFLUOROMETHYL-PYRIDIN-2-YL)-ACETONITRILE
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.3±0.1 g/cm3
    Boiling Point: 236.4±35.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.5 mmHg at 25°C
    Enthalpy of Vaporization: 47.3±3.0 kJ/mol
    Flash Point: 96.7±25.9 °C
    Index of Refraction: 1.457
    Molar Refractivity: 38.8±0.3 cm3
    #H bond acceptors: 2
    #H bond donors: 0
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 0.93
    ACD/LogD (pH 5.5): 1.52
    ACD/BCF (pH 5.5): 8.46
    ACD/KOC (pH 5.5): 160.46
    ACD/LogD (pH 7.4): 1.52
    ACD/BCF (pH 7.4): 8.46
    ACD/KOC (pH 7.4): 160.46
    Polar Surface Area: 37 Å2
    Polarizability: 15.4±0.5 10-24cm3
    Surface Tension: 33.9±3.0 dyne/cm
    Molar Volume: 142.4±3.0 cm3

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