Properties of 4-Mercaptophenylacetic acid

Thermophysical properties for 4-Mercaptophenylacetic acid (CAS: 39161-84-7). 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: 8, H: 8, O: 2, S: 1
  • CAS
    39161-84-7
  • Formula
    C8H8O2S
  • ID
    39161-84-7
  • InChI
    C8H8O2S/c9-8(10)5-6-1-3-7(11)4-2-6/h1-4,11H,5H2,(H,9,10)
  • InChI Key
    ORXSLDYRYTVAPC-UHFFFAOYSA-N
  • IUPAC Name
    2-(4-sulfanylphenyl)acetic acid
  • Molecular Weight (kg)
    168.213
  • Phase
    s
  • PubChem ID
    3.3905e+6
  • SMILES
    O=C(O)Cc1ccc(S)cc1
  • Synonyms

Physical Properties

  • Acentric factor
  • Critical pressure (bar)
    43.4539
  • Critical temperature (°C)
    598.441
  • Critical volume (m³/kmol)
    0.4535
  • Dipole moment
  • Melting temperature (°C)
    98.75
  • Normal boiling temperature (°C)
    349.52

State-dependent Properties

  • API gravity
    -10.3715
  • Compressibility factor
    0.00536472
  • Density (kg/m³)
    1281.62
  • 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))
    172.245
  • Molar volume (m³/kmol)
    0.13125
  • Parachor
    7.4508e-5
  • Poynting correction factor
    1.00594
  • Prandtl number
  • Saturation pressure (bar)
    6.0912e-7
  • Saturation temperature (°C)
    349.52
  • Solubility parameter
  • Specific enthalpy (kJ)
    0
  • Specific entropy (kJ/kg·K)
    0
  • Specific gravity
    1.28288
  • Specific heat capacity (kJ/kg·K)
    1.02397
  • Surface tension
    0.0683048
  • Thermal conductivity
  • Thermal diffusivity

Safety Properties

  • Autoignition temperature (°C)
    -273.15
  • Flash point temperature (°C)
    -273.15
  • Lower flammability limit
    0.0125456
  • Upper flammability limit
    0.0798358

Environmental Properties

  • Global warming potential
  • Ozone depletion potential