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Properties of methyl 1-(2,3,5-tri-O-acetyl-β-D-ribofuranosyl)-1H-1,2,4-triazole-3-carboxylate

Thermophysical properties for methyl 1-(2,3,5-tri-O-acetyl-β-D-ribofuranosyl)-1H-1,2,4-triazole-3-carboxylate (CAS: 39925-10-5). 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: 15, H: 19, N: 3, O: 9
  • CAS
    39925-10-5
  • Formula
    C15H19N3O9
  • ID
    39925-10-5
  • InChI
    C15H19N3O9/c1-7(19)24-5-10-11(25-8(2)20)12(26-9(3)21)14(27-10)18-6-16-13(17-18)15(22)23-4/h6,10-12,14H,5H2,1-4H3/t10-,11-,12-,14-/m1/s1
  • InChI Key
    OLQDKJGHMNCLOH-HKUMRIAESA-N
  • IUPAC Name
    methyl 1-[(2r,3r,4r,5r)-3,4-diacetyloxy-5-(acetyloxymethyl)oxolan-2-yl]-1,2,4-triazole-3-carboxylate
  • Molecular Weight (kg)
    385.326
  • Phase
    s
  • PubChem ID
    1.0151e+7
  • SMILES
    COC(=O)c1ncn([C@@H]2O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H]2OC(C)=O)n1
  • Synonyms

Physical Properties

  • Acentric factor
  • Critical pressure (bar)
    18.5631
  • Critical temperature (°C)
    895.251
  • Critical volume (m³/kmol)
    0.9765
  • Dipole moment
  • Melting temperature (°C)
    108
  • Normal boiling temperature (°C)
    669.57

State-dependent Properties

  • API gravity
    -29.2289
  • Compressibility factor
    0.0102621
  • Density (kg/m³)
    1534.76
  • 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))
    413.382
  • Molar volume (m³/kmol)
    0.251066
  • Parachor
    1.4383e-4
  • Poynting correction factor
    1.0115
  • Prandtl number
  • Saturation pressure (bar)
    7.4161e-15
  • Saturation temperature (°C)
    669.57
  • Solubility parameter
  • Specific enthalpy (kJ)
    0
  • Specific entropy (kJ/kg·K)
    0
  • Specific gravity
    1.53627
  • Specific heat capacity (kJ/kg·K)
    1.07281
  • Surface tension
    0.0666285
  • Thermal conductivity
  • Thermal diffusivity

Safety Properties

  • Autoignition temperature (°C)
    -273.15
  • Flash point temperature (°C)
    -273.15
  • Lower flammability limit
    0.00747384
  • Upper flammability limit
    0.0475608

Environmental Properties

  • Global warming potential
  • Ozone depletion potential