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Properties of 1-Chloro-6-isocyanatohexane

Thermophysical properties for 1-Chloro-6-isocyanatohexane (CAS: 13654-91-6). 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, Cl: 1, H: 12, N: 1, O: 1
  • CAS
    13654-91-6
  • Formula
    C7H12ClNO
  • ID
    13654-91-6
  • InChI
    C7H12ClNO/c8-5-3-1-2-4-6-9-7-10/h1-6H2
  • InChI Key
    MKMMDUNWJMDPHL-UHFFFAOYSA-N
  • IUPAC Name
    1-chloro-6-isocyanatohexane
  • Molecular Weight (kg)
    161.629
  • Phase
    l
  • PubChem ID
    1.1095e+7
  • SMILES
    O=C=NCCCCCCCl
  • Synonyms

Physical Properties

  • Acentric factor
    0.7923
  • Critical pressure (bar)
    29.0118
  • Critical temperature (°C)
    395.75
  • Critical volume (m³/kmol)
    0.521
  • Dipole moment
  • Melting temperature (°C)
    -273.15
  • Normal boiling temperature (°C)
    226.8

State-dependent Properties

  • API gravity
    12.3102
  • Compressibility factor
    0.00675883
  • Density (kg/m³)
    977.453
  • Dynamic viscosity (cP)
    0.769438
  • Enthalpy of vaporization (mass) (kJ)
    460.073
  • Enthalpy of vaporization (molar) (kJ/kmol)
    7.4361e+4
  • Gibbs free energy (kJ/kmol)
    0
  • Joule–Thomson coefficient
    -5.3433e-7
  • Kinematic viscosity
    7.8719e-7
  • Molar enthalpy (kJ/kmol)
    0
  • Molar entropy (kJ/(kmol·K))
    0
  • Molar heat capacity (kJ/(kmol·K))
    253.454
  • Molar volume (m³/kmol)
    0.165358
  • Parachor
    7.3019e-5
  • Poynting correction factor
    1.00678
  • Prandtl number
    9.02331
  • Saturation pressure (bar)
    1.5103e-4
  • Saturation temperature (°C)
    238.488
  • Solubility parameter
    2.0850e+4
  • Specific enthalpy (kJ)
    0
  • Specific entropy (kJ/kg·K)
    0
  • Specific gravity
    0.978415
  • Specific heat capacity (kJ/kg·K)
    1.56812
  • Surface tension
    0.0370047
  • Thermal conductivity
    0.133717
  • Thermal diffusivity
    8.7239e-8

Safety Properties

  • Autoignition temperature (°C)
    -273.15
  • Flash point temperature (°C)
    -273.15
  • Lower flammability limit
    0.0118996
  • Upper flammability limit
    0.0757248

Environmental Properties

  • Global warming potential
  • Ozone depletion potential