Most of the natural products isolated at present are heterocyclic compounds, so heterocyclic compounds occupy an important position in the research of organic chemistry. A compound: 7789-45-9, is researched, SMILESS is [Cu+2].[Br-].[Br-], Molecular Br2CuJournal, Reaction Kinetics, Mechanisms and Catalysis called Multicriteria optimization of the catalytic reaction for the synthesis of benzyl butyl ether based on the kinetic model, Author is Koledina, K. F.; Gubaydullin, I. M.; Koledin, S. N., the main research direction is benzyl butyl ethe multicriteria optimization catalysis r kinetics.Quality Control of Cupric bromide.
The work investigates the catalytic reaction of the benzyl Bu ether catalytic synthesis reaction by methods of math. modeling, based on exptl. data. Schematic technol. diagram of benzyl Bu ether production by intermol. dehydration of benzyl alc. with Bu alc. in the presence of a CuBr2 catalyst is given. A kinetic model of the process was developed according to a detailed scheme of chem. transformations. Intermol. dehydration of benzyl alc. and Bu alc. proceeds in three directions and leads to the formation of benzyl Bu, dibenzyl and di-Bu ethers. The problem of multicriteria optimization is formulated based on the kinetic model. Variable parameters are temperature, molar ratio of starting reagents and reaction time. Optimality criteria are maximizing the yield of the target benzyl Bu ether and minimizing the yield of byproducts. The solution of the multicriteria optimization problem was carried out by the NSGA-II Pareto-approximation algorithm. The results showed that an increase in the content of dibenzyl ether allows an increase in the yield of the target benzyl Bu ether. When the maximum permissible values of the molar ratio of the reactants, by-dibutyl ether increases yield while increasing the target output benzyl Bu.
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Reference:
Oxazolidine – Wikipedia,
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