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Properties of ethyl β-cyano-α-oxobenzenepropanoate

Thermophysical properties for ethyl β-cyano-α-oxobenzenepropanoate (CAS: 6362-63-6). 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: 12, H: 11, N: 1, O: 3
  • CAS
    6362-63-6
  • Formula
    C12H11NO3
  • ID
    6362-63-6
  • InChI
    C12H11NO3/c1-2-16-12(15)11(14)10(8-13)9-6-4-3-5-7-9/h3-7,10H,2H2,1H3
  • InChI Key
    YWNRATDDUSMBPR-UHFFFAOYSA-N
  • IUPAC Name
    ethyl 3-cyano-2-oxo-3-phenylpropanoate
  • Molecular Weight (kg)
    217.221
  • Phase
    s
  • PubChem ID
    2.2845e+4
  • SMILES
    CCOC(=O)C(=O)C(C#N)c1ccccc1
  • Synonyms

Physical Properties

  • Acentric factor
  • Critical pressure (bar)
    25.3027
  • Critical temperature (°C)
    669.313
  • Critical volume (m³/kmol)
    0.6515
  • Dipole moment
  • Melting temperature (°C)
    129.5
  • Normal boiling temperature (°C)
    441.42

State-dependent Properties

  • API gravity
    -7.07148
  • Compressibility factor
    0.00714831
  • Density (kg/m³)
    1242.07
  • 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))
    241.006
  • Molar volume (m³/kmol)
    0.174886
  • Parachor
    9.4021e-5
  • Poynting correction factor
    1.00788
  • Prandtl number
  • Saturation pressure (bar)
    8.5901e-9
  • Saturation temperature (°C)
    441.42
  • Solubility parameter
  • Specific enthalpy (kJ)
    0
  • Specific entropy (kJ/kg·K)
    0
  • Specific gravity
    1.24329
  • Specific heat capacity (kJ/kg·K)
    1.1095
  • Surface tension
    0.0555985
  • Thermal conductivity
  • Thermal diffusivity

Safety Properties

  • Autoignition temperature (°C)
    -273.15
  • Flash point temperature (°C)
    -273.15
  • Lower flammability limit
    0.00858436
  • Upper flammability limit
    0.0546278

Environmental Properties

  • Global warming potential
  • Ozone depletion potential