Evaluation of the gas stripping technique for calculation of Henry’s law constants using the initial slope method for 1,2,4,5-tetrachlorobenzene, pentachlorobenzene, and hexachlorobenzene

Abstract

Henry’s law constant (HLC) is an important factor used in environmental risk assessment and fate and transport models to describe mass transfer of chemical between water and air. HLCs and structure–property relationships were assessed for 1,2,4,5-tetrachlorobenzene (TeCB), pentachlorobenzene (PeCB), and hexachlorobenzene (HCB). HLCs were determined using the volatilization rate (kv) of sparged chemical at 25°C. Despite the assumption that kv should be constant throughout the stripping duration, results indicated that kv decreased over time according to three separate slope regions. Results of ANCOVA indicate that kv is statistically different in the third slope region, which leads to the conclusion that use of the entire stripping data set would lead to biased HLCs. This decrease in kv may be attributed to desorption from sparger surfaces, which has not been considered widely in the literature. Statistical analysis was possible because of the robustness of the current experimental procedure which included numerous replications (15 total spargers) and extensive data points available to discern key slope changes. HLCs determined using the gas stripping technique were 57, 33, and 30Pam3mol−1 for 1,2,4,5-TeCB, PeCB, and HCB, respectively. In comparison to literature values, current TeCB and HCB HLCs were within wide reference ranges spanning approximately an order of magnitude for each chemical. PeCB HLC of the current study was two times lower than the lowest reference data.