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Properties of benzoic acid, 4,5-dimethoxy-2-nitro-, ethyl ester

Thermophysical properties for benzoic acid, 4,5-dimethoxy-2-nitro-, ethyl ester (CAS: 100905-33-7). 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, H: 13, N: 1, O: 6
  • CAS
    100905-33-7
  • Formula
    C11H13NO6
  • ID
    100905-33-7
  • InChI
    C11H13NO6/c1-4-18-11(13)7-5-9(16-2)10(17-3)6-8(7)12(14)15/h5-6H,4H2,1-3H3
  • InChI Key
    VNPCXITWHOOQAJ-UHFFFAOYSA-N
  • IUPAC Name
    ethyl 4,5-dimethoxy-2-nitrobenzoate
  • Molecular Weight (kg)
    255.224
  • Phase
    s
  • PubChem ID
    3.4824e+6
  • SMILES
    CCOC(=O)c1cc(OC)c(OC)cc1[N+](=O)[O-]
  • Synonyms

Physical Properties

  • Acentric factor
  • Critical pressure (bar)
    24.8755
  • Critical temperature (°C)
    701.323
  • Critical volume (m³/kmol)
    0.6875
  • Dipole moment
  • Melting temperature (°C)
    99.5
  • Normal boiling temperature (°C)
    474.65

State-dependent Properties

  • API gravity
    -20.2923
  • Compressibility factor
    0.00742721
  • Density (kg/m³)
    1404.57
  • 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))
    277.791
  • Molar volume (m³/kmol)
    0.18171
  • Parachor
    1.0051e-4
  • Poynting correction factor
    1.00828
  • Prandtl number
  • Saturation pressure (bar)
    9.8469e-10
  • Saturation temperature (°C)
    474.65
  • Solubility parameter
  • Specific enthalpy (kJ)
    0
  • Specific entropy (kJ/kg·K)
    0
  • Specific gravity
    1.40595
  • Specific heat capacity (kJ/kg·K)
    1.08842
  • Surface tension
    0.0596587
  • 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