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Properties of 5-Chloro-2-(trifluoromethyl)benzeneacetonitrile

Thermophysical properties for 5-Chloro-2-(trifluoromethyl)benzeneacetonitrile (CAS: 261763-26-2). Use the selector below to view properties in different unit systems.

Calculation Conditions

The following state-dependent properties were calculated at these standard conditions.

Temperature

25 °C

Pressure

1.01325 bar

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Identification

  • Atoms
    C: 9, Cl: 1, F: 3, H: 5, N: 1
  • CAS
    261763-26-2
  • Formula
    C9H5ClF3N
  • ID
    261763-26-2
  • InChI
    C9H5ClF3N/c10-7-1-2-8(9(11,12)13)6(5-7)3-4-14/h1-2,5H,3H2
  • InChI Key
    XCPSZOAJWIBKNE-UHFFFAOYSA-N
  • IUPAC Name
    2-[5-chloro-2-(trifluoromethyl)phenyl]acetonitrile
  • Molecular Weight (kg)
    219.591
  • Phase
    s
  • PubChem ID
    2.7781e+6
  • SMILES
    N#CCc1cc(Cl)ccc1C(F)(F)F
  • Synonyms

Physical Properties

  • Acentric factor
  • Critical pressure (bar)
    26.0574
  • Critical temperature (°C)
    517.11
  • Critical volume (m³/kmol)
    0.5495
  • Dipole moment
  • Melting temperature (°C)
    62
  • Normal boiling temperature (°C)
    303.1

State-dependent Properties

  • API gravity
    -24.9761
  • Compressibility factor
    0.00612616
  • Density (kg/m³)
    1465.12
  • Dynamic viscosity (cP)
    0
  • Enthalpy of vaporization (mass) (kJ)
    0
  • Enthalpy of vaporization (molar) (kJ/kmol)
  • Gibbs free energy (kJ/kmol)
    0
  • Joule–Thomson coefficient
  • Kinematic viscosity
  • Molar enthalpy (kJ/kmol)
    0
  • Molar entropy (kJ/(kmol·K))
    0
  • Molar heat capacity (kJ/(kmol·K))
    178.412
  • Molar volume (m³/kmol)
    0.149879
  • Parachor
    7.5124e-5
  • Poynting correction factor
    1.00683
  • Prandtl number
  • Saturation pressure (bar)
    1.4077e-5
  • Saturation temperature (°C)
    303.1
  • Solubility parameter
  • Specific enthalpy (kJ)
    0
  • Specific entropy (kJ/kg·K)
    0
  • Specific gravity
    1.46656
  • Specific heat capacity (kJ/kg·K)
    0.812475
  • Surface tension
    0.0403682
  • Thermal conductivity
  • Thermal diffusivity

Safety Properties

  • Autoignition temperature (°C)
    -273.15
  • Flash point temperature (°C)
    -273.15
  • Lower flammability limit
    0.0110464
  • Upper flammability limit
    0.0702952

Environmental Properties

  • Global warming potential
  • Ozone depletion potential