Abstract
A stage six-path mechanism for the reaction of n-hexane hydroisomerization on a BEA Pt-zeolite catalyst has been proposed. The mass flow rate of n-hexane in the feed stream varies in the range of 0.7−2.8 h−1; the mole ratio of hydrogen to the n-hexane range of 2.7–14.6; the reactor temperature falls in the range from 453 to 573 K; and the gas flow pressure varies in the range of 1.0–10.0 atm. Thirty experiments have been carried out. In the product stream, the concentrations of n-hexane, 2-methylpentane, 3-methylpentane, 2,2-dimethylbutane, 2,3-dimethylbutane, propane, C1-alkanes, and C2-alkanes are analyzed by gas chromatography. A kinetic model has been constructed for the six-path mechanism of the reaction of n-hexane hydroisomerization, which contains 15 kinetic constants. Based on the results of laboratory experiments, the kinetic constants of the model have been estimated by the method of nonlinear least squares. The model has been shown to correspond with the experiment in the selected field of experimentation.
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Ciang, H. and Bhan, A., Catalytic consequences of hydroxyl group location on the kinetics of n-hexane hydroisomerization over acidic zeolites, J. Catal., 2011, vol. 283, p.98.
Guisnet, M., Fouche, V., Belloum, M., Bournonville, J.P., and Travers, C., Isomerization of n-hexane on platinum dealuminated mordenite. Catalysis II. Kinetic studies, Appl. Catal., A, 1991, vol. 71, p.295.
Bultanas, M.A., Van Raemdonck, K.K., Froment, G.F., and Mohedas, S.R., Fundamental kinetic modeling of hydroisomerization and hydrocracking on noblemetal-loaded faujasites, Ind. Eng. Chem. Res., 1989, vol. 28, no. 7, p.899.
Lima, P.M., Garetto, T., Cavalcante, C.L., and Cardoso, D., Isomerization of n-hexane on Pt-Ni catalysts supported on nanocrystalline H-BEA zeolite, Catal. Today, 2011, vol. 172, p.195.
Kinyakin, A.S., Glushachenkova, E.A., Shuvalov, A.S., Pisarenko, Yu.A., and Borutskii, P.N., Kinetics of the low-temperature isomerization of n-hexane on the NIP-3A catalyst in an isothermal flow reactor, Theor. Found. Chem. Eng., 2008, vol. 42, no. 6, p.815.
Garcia-Gutierrez, J.L., Cano, J.L., Aleman-Vazquez, L.O., and Jimenez-Cruz, F.I., Study of selectivity of MoO3-catalyzid C6–C7 hydrocarbones hydroisomerization: mechanistic insights into the formation of carbonaceous deposits on the catalyst surface, Fuel, 2012, vol. 94, p.532.
Belandria, L., Marin-Astorga, N., Garcia, E., Sosa, E., Aguirre, F., Villarroel, M., Uzcategui, A., and Imbert, F., Catalytic activity of Pt and Pd catalysts supported on HWP/HMS in the selective hydroisomerization of npentane. Effect of reaction temperature, Catal. Today, 2011, vol. 172, p.2.
Kulov, N.N. and Gordeev, L.S., Mathematical modeling in chemical engineering and biotechnology, Theor. Found. Chem. Eng., 2014, vol. 48, no. 3, pp. 225–229. doi doi 10.1134/S0040579514030099
Ziyatdinov, N.N., Computer simulation and optimization in chemical technology, Theor. Found. Chem. Eng., 2014, vol. 48, no. 5, pp. 539–540. https://doi.org/ 10.1134/S0040579514050261
Pisarenko, E.V. and Pisarenko, V.N., Analysis and simulation of the nonlinear kinetics of reacting chemical systems, Theor. Found. Chem. Eng., 2013, vol. 47, no. 2, p.128.
Pisarenko, E.V. and Pisarenko, V.N., Kinetics of the reaction of olefin synthesis from methanol and dimethyl ether, Theor. Found. Chem. Eng., 2008, vol. 42, no. 6, p. 822.
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Original Russian Text © E.V. Pisarenko, A.B. Ponomarev, V.N. Pisarenko, 2018, published in Teoreticheskie Osnovy Khimicheskoi Tekhnologii, 2018, Vol. 52, No. 1, pp. 26–37.
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Pisarenko, E.V., Ponomarev, A.B. & Pisarenko, V.N. Analysis and Modeling of the Hydroisomerization Process for n-Hexane. Theor Found Chem Eng 52, 24–34 (2018). https://doi.org/10.1134/S004057951801013X
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DOI: https://doi.org/10.1134/S004057951801013X