Properties of carbamic acid, dimethyl-, 6-(7-chloro-1,8-naphthyridin-2-yl)-6,7-dihydro-7-oxo-5H-pyrrolo[3,4-b]pyrazin-5-yl ester

Thermophysical properties for carbamic acid, dimethyl-, 6-(7-chloro-1,8-naphthyridin-2-yl)-6,7-dihydro-7-oxo-5H-pyrrolo[3,4-b]pyrazin-5-yl ester (CAS: 61500-71-8). 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: 17, Cl: 1, H: 13, N: 6, O: 3
  • CAS
    61500-71-8
  • Formula
    C17H13ClN6O3
  • ID
    61500-71-8
  • InChI
    C17H13ClN6O3/c1-23(2)17(26)27-16-13-12(19-7-8-20-13)15(25)24(16)11-6-4-9-3-5-10(18)21-14(9)22-11/h3-8,16H,1-2H3
  • InChI Key
    VSFTZLPLDDRCTL-UHFFFAOYSA-N
  • IUPAC Name
    [6-(7-chloro-1,8-naphthyridin-2-yl)-5-oxo-7h-pyrrolo[3,4-b]pyrazin-7-yl] n,n-dimethylcarbamate
  • Molecular Weight (kg)
    384.777
  • Phase
    s
  • PubChem ID
    2.2755e+7
  • SMILES
    CN(C)C(=O)OC1c2nccnc2C(=O)N1c1ccc2ccc(Cl)nc2n1
  • Synonyms

Physical Properties

  • Acentric factor
  • Critical pressure (bar)
    28.2933
  • Critical temperature (°C)
    1089.56
  • Critical volume (m³/kmol)
    0.9725
  • Dipole moment
  • Melting temperature (°C)
    270
  • Normal boiling temperature (°C)
    808.31

State-dependent Properties

  • API gravity
    -30.5079
  • Compressibility factor
    0.0102571
  • Density (kg/m³)
    1533.32
  • 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))
    367.04
  • Molar volume (m³/kmol)
    0.250944
  • Parachor
    1.5850e-4
  • Poynting correction factor
    1.01133
  • Prandtl number
  • Saturation pressure (bar)
    3.9741e-19
  • Saturation temperature (°C)
    808.31
  • Solubility parameter
  • Specific enthalpy (kJ)
    0
  • Specific entropy (kJ/kg·K)
    0
  • Specific gravity
    1.53482
  • Specific heat capacity (kJ/kg·K)
    0.953905
  • Surface tension
    0.104427
  • Thermal conductivity
  • Thermal diffusivity

Safety Properties

  • Autoignition temperature (°C)
    -273.15
  • Flash point temperature (°C)
    -273.15
  • Lower flammability limit
    0.00609418
  • Upper flammability limit
    0.0387812

Environmental Properties

  • Global warming potential
  • Ozone depletion potential