Properties of benzyl mercaptan

Thermophysical properties for benzyl mercaptan (CAS: 100-53-8). 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: 7, H: 8, S: 1
  • CAS
    100-53-8
  • Formula
    C7H8S
  • ID
    100-53-8
  • InChI
    C7H8S/c8-6-7-4-2-1-3-5-7/h1-5,8H,6H2
  • InChI Key
    UENWRTRMUIOCKN-UHFFFAOYSA-N
  • IUPAC Name
    phenylmethanethiol
  • Molecular Weight (kg)
    124.203
  • Phase
    l
  • PubChem ID
    7509
  • SMILES
    C1=CC=C(C=C1)CS
  • Synonyms

Physical Properties

  • Acentric factor
    0.299
  • Critical pressure (bar)
    40.6
  • Critical temperature (°C)
    444.85
  • Critical volume (m³/kmol)
    0.367
  • Dipole moment
  • Melting temperature (°C)
    -29.6
  • Normal boiling temperature (°C)
    199

State-dependent Properties

  • API gravity
    1.75428
  • Compressibility factor
    0.00482466
  • Density (kg/m³)
    1052.24
  • Dynamic viscosity (cP)
    0.930829
  • Enthalpy of vaporization (mass) (kJ)
    441.956
  • Enthalpy of vaporization (molar) (kJ/kmol)
    5.4892e+4
  • Gibbs free energy (kJ/kmol)
    0
  • Joule–Thomson coefficient
    -4.6788e-7
  • Kinematic viscosity
    8.8462e-7
  • Molar enthalpy (kJ/kmol)
    0
  • Molar entropy (kJ/(kmol·K))
    0
  • Molar heat capacity (kJ/(kmol·K))
    186.989
  • Molar volume (m³/kmol)
    0.118037
  • Parachor
    5.2763e-5
  • Poynting correction factor
    1.00483
  • Prandtl number
    9.94222
  • Saturation pressure (bar)
    5.6525e-4
  • Saturation temperature (°C)
    199.232
  • Solubility parameter
    2.1072e+4
  • Specific enthalpy (kJ)
    0
  • Specific entropy (kJ/kg·K)
    0
  • Specific gravity
    1.05327
  • Specific heat capacity (kJ/kg·K)
    1.5055
  • Surface tension
    0.0391594
  • Thermal conductivity
    0.140951
  • Thermal diffusivity
    8.8976e-8

Safety Properties

  • Autoignition temperature (°C)
    -273.15
  • Flash point temperature (°C)
    70
  • Lower flammability limit
    0.011634
  • Upper flammability limit
    0.0699192

Environmental Properties

  • Global warming potential
  • Ozone depletion potential