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Properties of 2-(4-Nitrophenyl) 1-(phenylmethyl) (2S)-1,2-pyrrolidinedicarboxylate

Thermophysical properties for 2-(4-Nitrophenyl) 1-(phenylmethyl) (2S)-1,2-pyrrolidinedicarboxylate (CAS: 3304-59-4). 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: 19, H: 18, N: 2, O: 6
  • CAS
    3304-59-4
  • Formula
    C19H18N2O6
  • ID
    3304-59-4
  • InChI
    C19H18N2O6/c22-18(27-16-10-8-15(9-11-16)21(24)25)17-7-4-12-20(17)19(23)26-13-14-5-2-1-3-6-14/h1-3,5-6,8-11,17H,4,7,12-13H2/t17-/m0/s1
  • InChI Key
    GXUFIJVKXYWCAO-KRWDZBQOSA-N
  • IUPAC Name
    1-o-benzyl 2-o-(4-nitrophenyl) (2s)-pyrrolidine-1,2-dicarboxylate
  • Molecular Weight (kg)
    370.356
  • Phase
    s
  • PubChem ID
    1.0134e+7
  • SMILES
    O=C(Oc1ccc([N+](=O)[O-])cc1)[C@@H]1CCCN1C(=O)OCc1ccccc1
  • Synonyms

Physical Properties

  • Acentric factor
  • Critical pressure (bar)
    20.2906
  • Critical temperature (°C)
    965.183
  • Critical volume (m³/kmol)
    0.9845
  • Dipole moment
  • Melting temperature (°C)
    94.75
  • Normal boiling temperature (°C)
    711.24

State-dependent Properties

  • API gravity
    -24.6441
  • Compressibility factor
    0.0102525
  • Density (kg/m³)
    1476.52
  • 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))
    403.221
  • Molar volume (m³/kmol)
    0.250831
  • Parachor
    1.4628e-4
  • Poynting correction factor
    1.01155
  • Prandtl number
  • Saturation pressure (bar)
    2.4944e-15
  • Saturation temperature (°C)
    711.24
  • Solubility parameter
  • Specific enthalpy (kJ)
    0
  • Specific entropy (kJ/kg·K)
    0
  • Specific gravity
    1.47797
  • Specific heat capacity (kJ/kg·K)
    1.08874
  • Surface tension
    0.0701772
  • 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