Continuum-uniform approach calculations of the solubility of hydrocarbons in water
作者： I. Tuñón , E. Silla , J.L. Pascual-Ahuir
DOI: 10.1016/0009-2614(93)85403-B
关键词: Aqueous solution 、 Thermodynamics 、 Hydrocarbon 、 Hydrophobic effect 、 Alkane 、 Surface tension 、 Mineralogy 、 Solubility 、 Cavitation 、 Solvent 、 Chemistry
摘要: Abstract The ransfer free energies from gas phase to water for some hydrocarbons are calculated by means of a continuum-uniform model the solvent. For calculation cavitation energy based on surface tension is proposed. values compared with experimental obtained and without corrective factor that accounts difference in solute—solvent sizes. Good agreement between theoretical corrected data obtained. Our calculations seem show hydrophobic effect directly related molecular area.
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