Thermal decomposition of propylene oxide with different activation energy and Reynolds number in a multicomponent tubular reactor containing a cooling jacket

Abstract

Abstract In this article, we are focusing on heat and mass transfer through a Multicomponent tubular reactor containing a cooling jacket by thermal decomposition of propylene oxide in water. The chemical reaction is an irreversible, 1st order reaction and an exothermic reaction that yields propylene glycol with enthalpy = −84,666 J/mol. The constant rate of the reaction is followed by the Arrhenius equation in which the activation energy is taken on a trial basis in the range from 75,000 to 80,000 J/mol with a fixed frequency factor. For the fluid to flow, the Reynolds number is kept in the range from 100 to 1000. The three partial differential equations of mass, momentum, and energy are coupled to study heat and mass transfer in a tubular reactor by using the chemistry interface in COMSOL Multiphysics 5.4. The initial concentration of propylene oxide is tested in the range from 2 to 3% and the thermal conductivity of the mixture is tested in the range 0.599–0.799. It was found that the amount deactivated of the compound decreases with an increase in Reynolds number. Propylene oxide is decomposed at about 99.8% at Re = 100 at lower activation energy and gives the total maximum enthalpy change in the tubular reactor. Observing the relationship between Sherwood numbers to Nusselt numbers, it was deducted that the convective heat transfer is opposite to convective mass transfer for high Reynolds numbers.