Determination of the Henry's law constants of low-volatility compounds via the measured air-phase transfer coefficients

Water Res. 2017 Sep 1:120:238-244. doi: 10.1016/j.watres.2017.04.074. Epub 2017 May 1.

Abstract

Accurate Henry's law constants (H) are unavailable for the majority of organic pollutants, especially those having a low volatility. A novel kinetics-based experimental method is introduced to determine H for a wide range of low-H compounds. The method consists of measuring independently the water-to-air transfer coefficient (KL) and the associated air-phase transfer coefficient (kG) of a low-H chemical (solute) in water when KL ≅ kGH prevails according to the two-film theory. The kG for a solute is obtained via a developed gas-dynamic equation that relates kG to the solute molecular weight and the solute-vapor escaping efficiency (β) through a boundary air layer. The value of β is only a function of the in situ air turbulence level, independent of the chemical species. Thus, the required β for solutes can be estimated from the evaporative rates of pure volatile liquids under the same ambient setting. By relating the estimated kG with the measured KL of a low-H solute, the solute H is established. The H values of 45 low-H chemicals, including many complex pesticides, in the range of ∼10-7 to ∼10-3 have thus been determined. The accountability of the method is underscored by the consistency of the measured and credible literature H values for a number of the low-H compounds studied.

Keywords: Air-water partition coefficients; Henry's law constants; Low-volatility compounds; Two-film resistance theory; Vapor-phase transfer coefficients.

MeSH terms

  • Chemical Phenomena*
  • Gases
  • Pesticides
  • Volatilization
  • Water
  • Water Purification*

Substances

  • Gases
  • Pesticides
  • Water