ChemSpider 2D Image | 2-[2-(2-fluoroethyl)pyrazol-3-yl]acetonitrile | C7H8FN3

2-[2-(2-fluoroethyl)pyrazol-3-yl]acetonitrile

  • Molecular FormulaC7H8FN3
  • Average mass153.157 Da
  • Monoisotopic mass153.070221 Da
  • ChemSpider ID32843737

More details:






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

[1-(2-Fluorethyl)-1H-pyrazol-5-yl]acetonitril [German] [ACD/IUPAC Name]
[1-(2-Fluoroethyl)-1H-pyrazol-5-yl]acetonitrile [ACD/IUPAC Name]
[1-(2-Fluoroéthyl)-1H-pyrazol-5-yl]acétonitrile [French] [ACD/IUPAC Name]
1429419-70-4 [RN]
1H-Pyrazole-5-acetonitrile, 1-(2-fluoroethyl)- [ACD/Index Name]
2-[1-(2-fluoroethyl)-1H-pyrazol-5-yl]acetonitrile
2-[2-(2-fluoroethyl)pyrazol-3-yl]acetonitrile
[2-(2-Fluoro-ethyl)-2H-pyrazol-3-yl]-acetonitrile
AKOS024050023
MFCD25371375

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 296.0±25.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.6 mmHg at 25°C
    Enthalpy of Vaporization: 53.6±3.0 kJ/mol
    Flash Point: 132.8±23.2 °C
    Index of Refraction: 1.535
    Molar Refractivity: 41.0±0.5 cm3
    #H bond acceptors: 3
    #H bond donors: 0
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: -0.26
    ACD/LogD (pH 5.5): 0.24
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 32.14
    ACD/LogD (pH 7.4): 0.24
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 32.14
    Polar Surface Area: 42 Å2
    Polarizability: 16.3±0.5 10-24cm3
    Surface Tension: 39.8±7.0 dyne/cm
    Molar Volume: 131.8±7.0 cm3

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