The Effects of Acid and Hydrogen Peroxide Stabilizer on the Thermal Hazard of Adipic Acid Green Synthesis

The synthesis of adipic acid, which is formed by the reaction of cyclohexene oxidized by hydrogen peroxide (H2O2), is hazardous because of the highly exothermic nature of this reaction and H2O2 decomposition. The objective of this comprehensive study was to investigate and illustrate the effects of sulfuric acid (H2SO4) and H2O2 stabilizer (EDTA) on the thermal hazard of H2O2 decomposition and the green synthesis of adipic acid, which also provided a reference to reduce the risk of the reactions. Various calorimetry techniques were carried out to characterize the exothermic behavior of the reactions. An HPLC device was used to characterize the yield of adipic acid and the conversion rate of the raw materials, cyclohexene and H2O2. Meanwhile, density functional theory calculations were performed to understand the reaction mechanism and the associated energies of H2O2 decomposition catalyzed by sodium tungstate dihydrate (Na2WO4 center dot 2H(2)O). Finally, combined with the calorimetry results, the risk of the adipic acid synthesis reaction was assessed using the intrinsic control index method (ITHI). The results show that the addition of H2SO4 and EDTA can reduce the exothermic heat of the H2O2 decomposition reaction and the green synthesis reaction of adipic acid. The yield of adipic acid was also increased. The hazard level of stage A was IV, and to remove more reaction heat, it was recommended to enhance the reflux cooling of stage A. The hazard level of stage B was I, which was very low and no further measures could be taken.

Automated summary

The effects of sulfuric acid (H2SO4) and H2O2 stabilizer (EDTA) on the thermal hazard of H2O2 decomposition and the green synthesis of adipic acid were investigated in this study. Various calorimetry techniques were used to characterize the exothermic behavior of the reactions. An HPLC device was used to analyze the yield of adipic acid and the conversion rate of the raw materials. The addition of H2SO4 and EDTA reduced the exothermic heat of the reactions and increased the yield of adipic acid.