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Properties of 1,3-Bis(1,1-dimethylethyl) 2-(3-cyanophenyl)imidodicarbonate

Thermophysical properties for 1,3-Bis(1,1-dimethylethyl) 2-(3-cyanophenyl)imidodicarbonate (CAS: 500024-52-2). 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: 17, H: 22, N: 2, O: 4
  • CAS
    500024-52-2
  • Formula
    C17H22N2O4
  • ID
    500024-52-2
  • InChI
    C17H22N2O4/c1-16(2,3)22-14(20)19(15(21)23-17(4,5)6)13-9-7-8-12(10-13)11-18/h7-10H,1-6H3
  • InChI Key
    UPFVGJRYWFWDNT-UHFFFAOYSA-N
  • IUPAC Name
    tert-butyl n-(3-cyanophenyl)-n-[(2-methylpropan-2-yl)oxycarbonyl]carbamate
  • Molecular Weight (kg)
    318.368
  • Phase
    s
  • PubChem ID
    2.1931e+7
  • SMILES
    CC(C)(C)OC(=O)N(C(=O)OC(C)(C)C)c1cccc(C#N)c1
  • Synonyms

Physical Properties

  • Acentric factor
  • Critical pressure (bar)
    15.8349
  • Critical temperature (°C)
    794.659
  • Critical volume (m³/kmol)
    0.9535
  • Dipole moment
  • Melting temperature (°C)
    60.35
  • Normal boiling temperature (°C)
    571.57

State-dependent Properties

  • API gravity
    -11.4961
  • Compressibility factor
    0.00993691
  • Density (kg/m³)
    1309.56
  • 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))
    392.254
  • Molar volume (m³/kmol)
    0.243111
  • Parachor
    1.2777e-4
  • Poynting correction factor
    1.01116
  • Prandtl number
  • Saturation pressure (bar)
    3.3864e-11
  • Saturation temperature (°C)
    571.573
  • Solubility parameter
  • Specific enthalpy (kJ)
    0
  • Specific entropy (kJ/kg·K)
    0
  • Specific gravity
    1.31085
  • Specific heat capacity (kJ/kg·K)
    1.23208
  • Surface tension
    0.0468915
  • Thermal conductivity
  • Thermal diffusivity

Safety Properties

  • Autoignition temperature (°C)
    -273.15
  • Flash point temperature (°C)
    -273.15
  • Lower flammability limit
    0.00557922
  • Upper flammability limit
    0.0355042

Environmental Properties

  • Global warming potential
  • Ozone depletion potential