Thermodynamics Research Center / ThermoML | Journal of Chemical Thermodynamics

Structural and interactional studies of homologous series of a,x-alkanediols in N,N-dimethylformamide

Mehta, S. K., Ram, G.[Ganga], Kumar, V.[Vishal], Bhasin, K. K.
J. Chem. Thermodyn. 2007, 39, 5, 781-790
ABSTRACT
The thermodynamic parameters viz. excess molar volume VE and ultrasonic velocity u, transport parameter viscosity g and spectroscopic parameters viz. IR, 1H and 13C NMR have been measured for the mixtures of a,x-alkanediols (1,2- ethanediol, 1,3-propanediol and 1,5-pentanediol) and N,N-dimethylformamide over the whole composition range at T = 308.15K. The partial molar quantities QEi , isentropic compressibility KE S , deviation in ultrasonic velocity uD, viscosity deviation Dg, deviation in Gibbs free energies of activation for viscous flow g(x) and excess NMR chemical shift dE have been estimated and analysed. The results reveal distinctly that the interaction between unlike molecules takes place through hydroxyl groups of a,x-alkanediols and the CO group of N,N-dimethylformamide. An excellent correlation between thermodynamic and spectroscopic measurements has been observed.
Compounds
# Formula Name
1 C2H6O2 1,2-ethanediol
2 C3H8O2 propan-1,3-diol
3 C5H12O2 1,5-pentanediol
4 C3H7NO dimethylformamide
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
  • VIBTUB:UFactor:8
  • 1
  • POMD
  • 1
  • Viscosity, Pa*s ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • CAPTUB:UFactor:8
  • 1
  • POMD
  • 1
  • Speed of sound, m/s ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • PULSEH:UFactor:4
  • 1
  • POMD
  • 2
  • Mass density, kg/m3 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • VIBTUB:UFactor:8
  • 1
  • POMD
  • 2
  • Viscosity, Pa*s ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • CAPTUB:UFactor:8
  • 1
  • POMD
  • 2
  • Speed of sound, m/s ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • PULSEH:UFactor:4
  • 1
  • POMD
  • 3
  • Mass density, kg/m3 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • VIBTUB:UFactor:8
  • 1
  • POMD
  • 3
  • Viscosity, Pa*s ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • CAPTUB:UFactor:8
  • 1
  • POMD
  • 3
  • Speed of sound, m/s ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • PULSEH:UFactor:4
  • 1
  • POMD
  • 4
  • Mass density, kg/m3 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • VIBTUB:UFactor:8
  • 1
  • POMD
  • 4
  • Viscosity, Pa*s ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • CAPTUB:UFactor:8
  • 1
  • POMD
  • 4
  • Speed of sound, m/s ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • PULSEH:UFactor:4
  • 1
  • POMD
  • 4
  • 1
  • Viscosity, Pa*s ; Liquid
  • Mole fraction - 1; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • CAPTUB:UFactor:8
  • 13
  • POMD
  • 4
  • 1
  • Speed of sound, m/s ; Liquid
  • Mole fraction - 1; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • PULSEH:UFactor:4
  • 13
  • POMD
  • 4
  • 1
  • Excess molar volume, m3/mol ; Liquid
  • Mole fraction - 1; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • DIRDIL:UFactor:4
  • 31
  • POMD
  • 4
  • 2
  • Viscosity, Pa*s ; Liquid
  • Mole fraction - 2; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • CAPTUB:UFactor:8
  • 12
  • POMD
  • 4
  • 2
  • Speed of sound, m/s ; Liquid
  • Mole fraction - 2; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • PULSEH:UFactor:4
  • 13
  • POMD
  • 4
  • 2
  • Excess molar volume, m3/mol ; Liquid
  • Mole fraction - 2; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • DIRDIL:UFactor:4
  • 58
  • POMD
  • 4
  • 3
  • Viscosity, Pa*s ; Liquid
  • Mole fraction - 3; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • CAPTUB:UFactor:8
  • 12
  • POMD
  • 4
  • 3
  • Speed of sound, m/s ; Liquid
  • Mole fraction - 3; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • PULSEH:UFactor:4
  • 13
  • POMD
  • 4
  • 3
  • Excess molar volume, m3/mol ; Liquid
  • Mole fraction - 3; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • DIRDIL:UFactor:4
  • 30