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Properties of o-Cresolphthalein complexone

Thermophysical properties for o-Cresolphthalein complexone (CAS: 2411-89-4). 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: 32, H: 32, N: 2, O: 12
  • CAS
    2411-89-4
  • Formula
    C32H32N2O12
  • ID
    2411-89-4
  • InChI
    C32H32N2O12/c1-17-7-21(9-19(29(17)43)11-33(13-25(35)36)14-26(37)38)32(24-6-4-3-5-23(24)31(45)46-32)22-8-18(2)30(44)20(10-22)12-34(15-27(39)40)16-28(41)42/h3-10,43-44H,11-16H2,1-2H3,(H,35,36)(H,37,38)(H,39,40)(H,41,42)
  • InChI Key
    IYZPEGVSBUNMBE-UHFFFAOYSA-N
  • IUPAC Name
    2-[[5-[1-[3-[[bis(carboxymethyl)amino]methyl]-4-hydroxy-5-methylphenyl]-3-oxo-2-benzofuran-1-yl]-2-hydroxy-3-methylphenyl]methyl-(carboxymethyl)amino]acetic acid
  • Molecular Weight (kg)
    636.603
  • Phase
    s
  • PubChem ID
    7.5485e+4
  • SMILES
    Cc1cc(C2(c3cc(C)c(O)c(CN(CC(=O)O)CC(=O)O)c3)OC(=O)c3ccccc32)cc(CN(CC(=O)O)CC(=O)O)c1O
  • Synonyms

Physical Properties

  • Acentric factor
  • Critical pressure (bar)
    14.8844
  • Critical temperature (°C)
    2328.36
  • Critical volume (m³/kmol)
    1.5645
  • Dipole moment
  • Melting temperature (°C)
    186
  • Normal boiling temperature (°C)
    1588.37

State-dependent Properties

  • API gravity
    -68.1481
  • Compressibility factor
    0.0103113
  • Density (kg/m³)
    2523.51
  • 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))
    697.938
  • Molar volume (m³/kmol)
    0.252269
  • Parachor
    1.3437e-4
  • Poynting correction factor
    1.01175
  • Prandtl number
  • Saturation pressure (bar)
    3.1084e-22
  • Saturation temperature (°C)
    1588.37
  • Solubility parameter
  • Specific enthalpy (kJ)
    0
  • Specific entropy (kJ/kg·K)
    0
  • Specific gravity
    2.52599
  • Specific heat capacity (kJ/kg·K)
    1.09635
  • Surface tension
    0.0465493
  • Thermal conductivity
  • Thermal diffusivity

Safety Properties

  • Autoignition temperature (°C)
    -273.15
  • Flash point temperature (°C)
    -273.15
  • Lower flammability limit
    0.00337755
  • Upper flammability limit
    0.0214935

Environmental Properties

  • Global warming potential
  • Ozone depletion potential