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Properties of 3-(2-Chloro-6-fluorophenyl)-5-methylisoxazole-4-carboxylic acid

Thermophysical properties for 3-(2-Chloro-6-fluorophenyl)-5-methylisoxazole-4-carboxylic acid (CAS: 3919-74-2). 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: 11, Cl: 1, F: 1, H: 7, N: 1, O: 3
  • CAS
    3919-74-2
  • Formula
    C11H7ClFNO3
  • ID
    3919-74-2
  • InChI
    C11H7ClFNO3/c1-5-8(11(15)16)10(14-17-5)9-6(12)3-2-4-7(9)13/h2-4H,1H3,(H,15,16)
  • InChI Key
    REIPZLFZMOQHJT-UHFFFAOYSA-N
  • IUPAC Name
    3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazole-4-carboxylic acid
  • Molecular Weight (kg)
    255.63
  • Phase
    s
  • PubChem ID
    7.7520e+4
  • SMILES
    Cc1onc(-c2c(F)cccc2Cl)c1C(=O)O
  • Synonyms

Physical Properties

  • Acentric factor
  • Critical pressure (bar)
    33.2584
  • Critical temperature (°C)
    758.843
  • Critical volume (m³/kmol)
    0.6185
  • Dipole moment
  • Melting temperature (°C)
    206.5
  • Normal boiling temperature (°C)
    510.84

State-dependent Properties

  • API gravity
    -32.2555
  • Compressibility factor
    0.0068044
  • Density (kg/m³)
    1535.57
  • 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))
    223.193
  • Molar volume (m³/kmol)
    0.166472
  • Parachor
    9.6529e-5
  • Poynting correction factor
    1.00739
  • Prandtl number
  • Saturation pressure (bar)
    5.3069e-11
  • Saturation temperature (°C)
    510.84
  • Solubility parameter
  • Specific enthalpy (kJ)
    0
  • Specific entropy (kJ/kg·K)
    0
  • Specific gravity
    1.53708
  • Specific heat capacity (kJ/kg·K)
    0.87311
  • Surface tension
    0.0799539
  • Thermal conductivity
  • Thermal diffusivity

Safety Properties

  • Autoignition temperature (°C)
    -273.15
  • Flash point temperature (°C)
    -273.15
  • Lower flammability limit
    0.0100825
  • Upper flammability limit
    0.0641613

Environmental Properties

  • Global warming potential
  • Ozone depletion potential