Thermodynamics Research Center / ThermoML | Journal of Chemical and Engineering Data

Hydration of Thiourea and Mono-, Di-, and Tetra-N-Alkylthioureas at Infinite Dilution: A Thermodynamic Study at a Temperature of 298.15 K

Badea, E.[Elena], Della Gatta, G.[Giuseppe], Giancola, C. [Concetta], Jozwiak, M.[Malgorzata]
J. Chem. Eng. Data 2011, 56, 12, 4778-4785
ABSTRACT
Molar enthalpies of solution in water, ?solHm, of thiourea, methylthiourea, ethylthiourea, dimethyl-1,3-thiourea, diethyl-1,3-thiourea, and tetramethyl-1,1,3,3-thiourea were measured at T = (296.84, 302.45, and 306.89) K by isothermal calorimetry. Experimental results were used to derive molar enthalpies of solvation at infinite dilution (i.d.), ?solvHm8, changes in heat capacity due to the solution process, ?solCp,m8, and partial molar heat capacities at i.d., Cp,28, at T = 298.15 K. The methylene group contributions to the enthalpy of solvation and partial molar heat capacity were -4.5 kJ*mol 1 and 88.5 J*K 1*mol 1, respectively, in good agreement with our earlier data for N-alkylureas and the literature data for various homologous series of alkyl-substituted compounds. The contributions of the functional groups to both ?solvHm8 and Cp,28 were derived by employing additive schemes and compared with our earlier data for urea and corresponding N-alkylureas. Hydration behavior at the i.d. of thiourea, urea, and corresponding N-alkyl derivatives were compared and discussed.
Compounds
# Formula Name
1 CH4N2S thiourea
2 H2O water
3 C2H6N2S 1-methyl-2-thiourea
4 C3H8N2S ethylthiourea
5 C3H8N2S N,N'-dimethylthiourea
6 C5H12N2S N,N'-diethylthiourea
7 C5H12N2S 1,1,3,3-tetramethyl-2-thiourea
Datasets
The table above is generated from the ThermoML associated json file (link above). POMD and RXND refer to PureOrMixture and Reaction Datasets. The compound numbers are included in properties, variables, and phases, if specificied; the numbers refer to the table of compounds on the left.
Type Compound-# Property Variable Constraint Phase Method #Points
  • POMD
  • 1
  • 2
  • Molar enthalpy of solution, kJ/mol ; Liquid
  • Temperature, K; Liquid
  • Molality, mol/kg - 1; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Calvet calorimetry
  • 11
  • POMD
  • 3
  • 2
  • Molar enthalpy of solution, kJ/mol ; Liquid
  • Temperature, K; Liquid
  • Molality, mol/kg - 3; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Calvet calorimetry
  • 10
  • POMD
  • 4
  • 2
  • Molar enthalpy of solution, kJ/mol ; Liquid
  • Temperature, K; Liquid
  • Molality, mol/kg - 4; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Calvet calorimetry
  • 11
  • POMD
  • 5
  • 2
  • Molar enthalpy of solution, kJ/mol ; Liquid
  • Temperature, K; Liquid
  • Molality, mol/kg - 5; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Calvet calorimetry
  • 10
  • POMD
  • 6
  • 2
  • Molar enthalpy of solution, kJ/mol ; Liquid
  • Temperature, K; Liquid
  • Molality, mol/kg - 6; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Calvet calorimetry
  • 9
  • POMD
  • 7
  • 2
  • Molar enthalpy of solution, kJ/mol ; Liquid
  • Temperature, K; Liquid
  • Molality, mol/kg - 7; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Calvet calorimetry
  • 11