Thermodynamics Research Center / ThermoML | Fluid Phase Equilibria

Compatible solutes: Thermodynamic properties relevant for effective protection against osmotic stress

Held, C.[Christoph], Sadowski, G.[Gabriele]
Fluid Phase Equilib. 2016, 407, 224-235
ABSTRACT
Organisms developed very different strategies to protect themselves against osmotic stress. To sustain high salt concentrations of their surrounding some organisms accumulate so-called compatible solutes (CSs), which increase the internal osmotic pressure without disturbing the organism s metabolism. At constant temperature, osmotic pressure is mainly determined by the concentration of the compatible solute and the osmotic coefficient of the aqueous solution, and to a minor extent also by solution densities. Thus, osmotic coefficients and densities were measured for aqueous CS solutions in a broad range of concentration and at three temperatures (273 K, 310 K, 323 K) at atmospheric pressure. Further, the solubility of CSs in water was measured as function of temperature to determine the maximum CS concentration that can be applied in aqueous solutions. CSs under investigation were trimethylamine Noxide (TMAO), trehalose, citrulline, N,N-dimethylglycine, DMSO, glycerol, methylglycine, and ectoine. The data was used to calculate real osmotic pressures induced by these CSs. PC-SAFT was applied to model thermodynamic properties and phase equilibria of aqueous CS solutions in quantitative agreement to experimental data. Among the CSs investigated in this work, TMAO induced the highest osmotic pressure and thus can be considered the best protector against osmotic stress. The data was finally analyzed concerning the influence of CSs molecular size, charge, and hydrophobicity on osmotic pressure. This included also the comparison to incompatible solutes (urea, glycine).
Compounds
# Formula Name
1 C5H11NO2 (trimethylammonio)acetate
2 C12H22O11 .alpha.-trehalose
3 C3H9NO trimethylamine oxide
4 C6H13N3O3 N5-aminocarbonyl-L-ornithine
5 C4H9NO2 (Dimethylamino)acetic acid
6 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
  • 3
  • 6
  • Mass density, kg/m3 ; Liquid
  • Molality, mol/kg - 3; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Vibrating tube method
  • 6
  • POMD
  • 3
  • 6
  • Osmotic coefficient ; Liquid
  • Temperature, K; Liquid
  • Molality, mol/kg - 3; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • boiling point elevation
  • 11
  • POMD
  • 3
  • 6
  • Molality, mol/kg - 3 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 3
  • Optical Method
  • 4
  • POMD
  • 3
  • 6
  • Molality, mol/kg - 3 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 3
  • DSC
  • 3
  • POMD
  • 2
  • 6
  • Mass density, kg/m3 ; Liquid
  • Molality, mol/kg - 2; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Vibrating tube method
  • 4
  • POMD
  • 2
  • 6
  • Osmotic coefficient ; Liquid
  • Molality, mol/kg - 2; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • boiling point elevation
  • 10
  • POMD
  • 5
  • 6
  • Mass density, kg/m3 ; Liquid
  • Molality, mol/kg - 5; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Vibrating tube method
  • 4
  • POMD
  • 5
  • 6
  • Osmotic coefficient ; Liquid
  • Temperature, K; Liquid
  • Molality, mol/kg - 5; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • boiling point elevation
  • 15
  • POMD
  • 5
  • 6
  • Molality, mol/kg - 5 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 5
  • Optical Method
  • 1
  • POMD
  • 4
  • 6
  • Mass density, kg/m3 ; Liquid
  • Molality, mol/kg - 4; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Vibrating tube method
  • 3
  • POMD
  • 4
  • 6
  • Osmotic coefficient ; Liquid
  • Temperature, K; Liquid
  • Molality, mol/kg - 4; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • boiling point elevation
  • 8
  • POMD
  • 4
  • 6
  • Molality, mol/kg - 4 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 4
  • Optical Method
  • 7
  • POMD
  • 4
  • 6
  • Molality, mol/kg - 4 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 4
  • DSC
  • 3
  • POMD
  • 1
  • 6
  • Molality, mol/kg - 1 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 1
  • Optical Method
  • 1