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

Buffers and Ionic Salts: Densities and Solubilities of Aqueous and Electrolyte Solutions of Tris(hydroxymethyl)aminomethane and N-Tris[hydroxymethyl]-4-amino-butanesulfonic Acid

Taha, M.[Mohamed], Lee, M. J.[Ming-Jer]
J. Chem. Eng. Data 2009, 54, 9, 2501-2512
ABSTRACT
The densities of aqueous solutions of tris(hydroxymethyl)aminomethane (TRIS) and tris[hydroxymethyl]-4-amino-butanesulfonic acid (TABS), useful biological buffers within the pH range of 7.0 to 9.0 for TRIS and 8.2 to 9.5 for TABS, have been measured by a high-precision vibrating-tube digital densitometer in aqueous and in aqueous electrolyte solutions from (298.15 to 328.15) K under atmospheric pressure. This study was undertaken to investigate the interactions between these compounds and electrolytes of potassium acetate (KAc), potassium bromide (KBr), potassium chloride (KCl), and sodium chloride (NaCl). In this series of measurements, the aqueous samples were prepared with various concentrations of the buffers, up to saturated conditions, and over salt concentrations from (1 to 4) mol*dm-3. The experimental densities were correlated as a function of the concentration of the buffers and ionic salts. The solubilities of buffers at 298.15 K in aqueous and in aqueous electrolyte solutions have also been determined from the experimental results of density measurements. It was found that the solubilities of TRIS and TABS in aqueous solution decrease with increasing concentration of salts (salting-out effect). The solubility data were further used to estimate the apparent free energy of transfer (?Gtr') of buffers from water to aqueous electrolyte solutions. The contribution of TABS residue (-CH2CH2CH2CH2SO3-) from water to aqueous electrolyte solutions was predicted from the ?Gtr' results. The measured densities served to evaluate the apparent molar volumes, V(m, T), and fitted them to an equation that describes the surface (V against T against m). The apparent molar volumes of buffers at infinite dilution (Vo) have been determined from the solubility data. The trends of transfer volumes (?trVo) have been interpreted in terms of solute-cosolute interactions on the basis of a cosphere overlap model.
Compounds
# Formula Name
1 C4H11NO3 2-amino-2-(hydroxymethyl)-1,3-propanediol
2 C8H19NO6S N-tris(Hydroxymethyl)methyl-4-aminobutanesulfonic acid
3 ClK potassium chloride
4 C2H3KO2 potassium ethanoate
5 BrK potassium bromide
6 ClNa sodium chloride
7 H2O water
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
  • 7
  • Molality, mol/kg ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 1
  • Density Variation
  • 1
  • POMD
  • 1
  • 7
  • Mass density, kg/m3 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 1
  • VIBTUB:UFactor:32
  • 1
  • POMD
  • 1
  • 7
  • Mass density, kg/m3 ; Liquid
  • Temperature, K; Liquid
  • Molality, mol/kg - 1; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • VIBTUB:UFactor:32
  • 42
  • POMD
  • 7
  • 2
  • Molality, mol/kg ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 2
  • Density Variation
  • 1
  • POMD
  • 7
  • 2
  • Mass density, kg/m3 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 7
  • VIBTUB:UFactor:32
  • 1
  • POMD
  • 7
  • 2
  • Mass density, kg/m3 ; Liquid
  • Temperature, K; Liquid
  • Molality, mol/kg - 2; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • VIBTUB:UFactor:16
  • 42
  • POMD
  • 1
  • 4
  • 7
  • Molality, mol/kg - 1 ; Liquid
  • Solvent: Amount concentration (molarity), mol/dm3 - 4; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Crystal - 1
  • Density Variation
  • 3
  • POMD
  • 1
  • 4
  • 7
  • Mass density, kg/m3 ; Liquid
  • Solvent: Amount concentration (molarity), mol/dm3 - 4; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Crystal - 1
  • VIBTUB:UFactor:32
  • 3
  • POMD
  • 1
  • 4
  • 7
  • Mass density, kg/m3 ; Liquid
  • Temperature, K; Liquid
  • Molality, mol/kg - 1; Liquid
  • Solvent: Amount concentration (molarity), mol/dm3 - 4; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • VIBTUB:UFactor:16
  • 120
  • POMD
  • 1
  • 7
  • 5
  • Molality, mol/kg - 1 ; Liquid
  • Solvent: Amount concentration (molarity), mol/dm3 - 5; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Crystal - 1
  • Density Variation
  • 3
  • POMD
  • 1
  • 7
  • 5
  • Mass density, kg/m3 ; Liquid
  • Solvent: Amount concentration (molarity), mol/dm3 - 5; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Crystal - 1
  • VIBTUB:UFactor:32
  • 3
  • POMD
  • 1
  • 7
  • 5
  • Mass density, kg/m3 ; Liquid
  • Temperature, K; Liquid
  • Molality, mol/kg - 1; Liquid
  • Solvent: Amount concentration (molarity), mol/dm3 - 5; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • VIBTUB:UFactor:16
  • 114
  • POMD
  • 1
  • 3
  • 7
  • Molality, mol/kg - 1 ; Liquid
  • Solvent: Amount concentration (molarity), mol/dm3 - 3; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Crystal - 1
  • Density Variation
  • 3
  • POMD
  • 1
  • 3
  • 7
  • Mass density, kg/m3 ; Liquid
  • Solvent: Amount concentration (molarity), mol/dm3 - 3; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Crystal - 1
  • VIBTUB:UFactor:32
  • 3
  • POMD
  • 1
  • 3
  • 7
  • Mass density, kg/m3 ; Liquid
  • Temperature, K; Liquid
  • Molality, mol/kg - 1; Liquid
  • Solvent: Amount concentration (molarity), mol/dm3 - 3; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • VIBTUB:UFactor:16
  • 138
  • POMD
  • 1
  • 6
  • 7
  • Molality, mol/kg - 1 ; Liquid
  • Solvent: Amount concentration (molarity), mol/dm3 - 6; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Crystal - 1
  • Density Variation
  • 3
  • POMD
  • 1
  • 6
  • 7
  • Mass density, kg/m3 ; Liquid
  • Solvent: Amount concentration (molarity), mol/dm3 - 6; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Crystal - 1
  • VIBTUB:UFactor:32
  • 3
  • POMD
  • 1
  • 6
  • 7
  • Mass density, kg/m3 ; Liquid
  • Temperature, K; Liquid
  • Molality, mol/kg - 1; Liquid
  • Solvent: Amount concentration (molarity), mol/dm3 - 6; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • VIBTUB:UFactor:16
  • 144
  • POMD
  • 4
  • 7
  • 2
  • Molality, mol/kg - 2 ; Liquid
  • Solvent: Amount concentration (molarity), mol/dm3 - 4; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Crystal - 7
  • Density Variation
  • 3
  • POMD
  • 4
  • 7
  • 2
  • Mass density, kg/m3 ; Liquid
  • Solvent: Amount concentration (molarity), mol/dm3 - 4; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Crystal - 7
  • VIBTUB:UFactor:32
  • 3
  • POMD
  • 4
  • 7
  • 2
  • Mass density, kg/m3 ; Liquid
  • Temperature, K; Liquid
  • Molality, mol/kg - 2; Liquid
  • Solvent: Amount concentration (molarity), mol/dm3 - 4; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • VIBTUB:UFactor:32
  • 150
  • POMD
  • 7
  • 5
  • 2
  • Molality, mol/kg - 2 ; Liquid
  • Solvent: Amount concentration (molarity), mol/dm3 - 5; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Crystal - 7
  • Density Variation
  • 3
  • POMD
  • 7
  • 5
  • 2
  • Mass density, kg/m3 ; Liquid
  • Solvent: Amount concentration (molarity), mol/dm3 - 5; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Crystal - 7
  • VIBTUB:UFactor:32
  • 3
  • POMD
  • 7
  • 5
  • 2
  • Mass density, kg/m3 ; Liquid
  • Temperature, K; Liquid
  • Molality, mol/kg - 2; Liquid
  • Solvent: Amount concentration (molarity), mol/dm3 - 5; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • VIBTUB:UFactor:32
  • 108
  • POMD
  • 3
  • 7
  • 2
  • Molality, mol/kg - 2 ; Liquid
  • Solvent: Amount concentration (molarity), mol/dm3 - 3; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Crystal - 7
  • Density Variation
  • 3
  • POMD
  • 3
  • 7
  • 2
  • Mass density, kg/m3 ; Liquid
  • Solvent: Amount concentration (molarity), mol/dm3 - 3; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Crystal - 7
  • VIBTUB:UFactor:32
  • 3
  • POMD
  • 3
  • 7
  • 2
  • Mass density, kg/m3 ; Liquid
  • Temperature, K; Liquid
  • Molality, mol/kg - 2; Liquid
  • Solvent: Amount concentration (molarity), mol/dm3 - 3; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • VIBTUB:UFactor:32
  • 126
  • POMD
  • 6
  • 7
  • 2
  • Molality, mol/kg - 2 ; Liquid
  • Solvent: Amount concentration (molarity), mol/dm3 - 6; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Crystal - 7
  • Density Variation
  • 3
  • POMD
  • 6
  • 7
  • 2
  • Mass density, kg/m3 ; Liquid
  • Solvent: Amount concentration (molarity), mol/dm3 - 6; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Crystal - 7
  • VIBTUB:UFactor:32
  • 3
  • POMD
  • 6
  • 7
  • 2
  • Mass density, kg/m3 ; Liquid
  • Temperature, K; Liquid
  • Molality, mol/kg - 2; Liquid
  • Solvent: Amount concentration (molarity), mol/dm3 - 6; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • VIBTUB:UFactor:32
  • 144