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Properties of 3-nitrobenzotrifluoride

Thermophysical properties for 3-nitrobenzotrifluoride (CAS: 98-46-4). 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: 7, F: 3, H: 4, N: 1, O: 2
  • CAS
    98-46-4
  • Formula
    C7H4F3NO2
  • ID
    98-46-4
  • InChI
    C7H4F3NO2/c8-7(9,10)5-2-1-3-6(4-5)11(12)13/h1-4H
  • InChI Key
    WHNAMGUAXHGCHH-UHFFFAOYSA-N
  • IUPAC Name
    1-nitro-3-(trifluoromethyl)benzene
  • Molecular Weight (kg)
    191.107
  • Phase
    l
  • PubChem ID
    7386
  • SMILES
    C1=CC(=CC(=C1)[N+](=O)[O-])C(F)(F)F
  • Synonyms

Physical Properties

  • Acentric factor
    0.536
  • Critical pressure (bar)
    28
  • Critical temperature (°C)
    393.85
  • Critical volume (m³/kmol)
    0.46
  • Dipole moment
  • Melting temperature (°C)
    -3.7
  • Normal boiling temperature (°C)
    202.8

State-dependent Properties

  • API gravity
    -22.191
  • Compressibility factor
    0.00607838
  • Density (kg/m³)
    1285.1
  • Dynamic viscosity (cP)
    0.650173
  • Enthalpy of vaporization (mass) (kJ)
    309.795
  • Enthalpy of vaporization (molar) (kJ/kmol)
    5.9204e+4
  • Gibbs free energy (kJ/kmol)
    0
  • Joule–Thomson coefficient
    -5.5408e-7
  • Kinematic viscosity
    5.0593e-7
  • Molar enthalpy (kJ/kmol)
    0
  • Molar entropy (kJ/(kmol·K))
    0
  • Molar heat capacity (kJ/(kmol·K))
    214.117
  • Molar volume (m³/kmol)
    0.14871
  • Parachor
    6.4447e-5
  • Poynting correction factor
    1.00609
  • Prandtl number
    6.10971
  • Saturation pressure (bar)
    3.8720e-4
  • Saturation temperature (°C)
    202.746
  • Solubility parameter
    1.9531e+4
  • Specific enthalpy (kJ)
    0
  • Specific entropy (kJ/kg·K)
    0
  • Specific gravity
    1.28637
  • Specific heat capacity (kJ/kg·K)
    1.1204
  • Surface tension
    0.0344237
  • Thermal conductivity
    0.119229
  • Thermal diffusivity
    8.2808e-8

Safety Properties

  • Autoignition temperature (°C)
    -273.15
  • Flash point temperature (°C)
    84.2862
  • Lower flammability limit
    0.0160256
  • Upper flammability limit
    0.101981

Environmental Properties

  • Global warming potential
  • Ozone depletion potential