Thermodynamics Research Center / ThermoML | Thermochimica Acta

Volume-related interaction parameters for dilute solutions of 1,3-dimethylpropyleneurea in normal and heavy water between 278.15 K and 318.15 K

Ivanov, E. V.[Evgeniy V.], Lebedeva, E. Y.[Elena Yu.], Abrosimov, V. K.[Vladimir K.]
Thermochim. Acta 2011, 513, 1-2, 26-32
ABSTRACT
Density measurements were carried out on dilute solutions of 1,3-dimethylpropyleneurea (DMPU) in normal (H2O) and heavy (D2O) water in the aquamolality range from 0.04 to 1.0 at 278.15, 288.15, 298.15, 308.15, 313.15 and 318.15 K. The excess partial molar volumes of DMPU ( ) and volume second virial coefficients (vxx), calculated from the densities of the H/D isotopically distinguishable solutions, are negative, which indicate that the solute has a predominantly structuremaking effect on aqueous surroundings. With decreasing temperature and on going from H2O to D2O, values of and vxx become more negative, suggesting that the hydration sphere around a DMPU molecule is more structured in the specified cases. Comparing the obtained results with earlier those for the analogues of DMPU such as acyclic 1,1,3,3-tetramethylurea (TMU) and cyclic 1,3- dimethylpropyleneurea (DMEU) corroborates the previously made conclusion that the DMPU molecule, being a stronger hydrated, has a more pronounced structure-making effect on water (H2O or D2O) than the TMU or DMEU molecule
Compounds
# Formula Name
1 C6H12N2O 1,3-dimethyl-3,4,5,6-tetrahydro-2(1H)-pyrimidinone
2 H2O water
3 D2O water-d2
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
  • Mass density, kg/m3 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Vibrating tube method
  • 6
  • POMD
  • 3
  • Mass density, kg/m3 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Vibrating tube method
  • 6
  • POMD
  • 1
  • 2
  • Mass density, kg/m3 ; Liquid
  • Molality, mol/kg - 1; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Vibrating tube method
  • 66
  • POMD
  • 1
  • 3
  • Mass density, kg/m3 ; Liquid
  • Molality, mol/kg - 1; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Vibrating tube method
  • 72