Mathematical Modeling of Induction Period of the Olefins Hydroalumination Reaction by Diisobutylaluminiumchloride Catalyzed with Cp<sub>2</sub>ZrCl<sub>2</sub>

Authors

  • Irek Gubaydullin Russian Academy of Science
  • Kamila Koledina Russian Academy of Science
  • Leniza Sayfullina Russian Academy of Science

DOI:

https://doi.org/10.4186/ej.2014.18.1.13

Keywords:

Olefin hydroalumination, organoaluminium compounds, detailed elaboration, information-analytical system, mathematical description, dimer, catalytic cycle.

Abstract

Method of mathematical modeling of induction period for reaction of olefins hydroalumination by alkylalanes in presence Cp2ZrCl2 was developed. The kinetic model of reaction of olefins hydroalumination by alkylalanes with presence the catalyst Cp2ZrCl2 was built. The values of kinetic parameters of reaction of olefins hydroalumination by alkylalanes in presence Cp2ZrCl2 which describes well an experimental data were determined. Obtained values are allowed to describe an induction period in all experimentally investigated area. The stages of mechanism of reaction of olefins hydroalumination by alkylalanes in presence Cp2ZrCl2 which determine an existence of induction period were found. The software of mathematical modeling of induction period which allows to define stages determined an existence of induction period was developed. It can be used for wide class of investigated reactions.

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Author Biographies

Irek Gubaydullin
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Institute of Petrochemistry and Catalysis, Russian Academy of Science, Ufa, Bashkortostan, Russia

Kamila Koledina
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Institute of Petrochemistry and Catalysis, Russian Academy of Science, Ufa, Bashkortostan, Russia

Leniza Sayfullina
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Institute of Petrochemistry and Catalysis, Russian Academy of Science, Ufa, Bashkortostan, Russia
Bashkir State University, Ufa, Bashkortostan, Russia

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Published In
Vol 18 No 1, Jan 14, 2014
How to Cite
[1]
I. Gubaydullin, K. Koledina, and L. Sayfullina, “Mathematical Modeling of Induction Period of the Olefins Hydroalumination Reaction by Diisobutylaluminiumchloride Catalyzed with Cp<sub>2</sub>ZrCl<sub>2</sub>”, Eng. J., vol. 18, no. 1, pp. 13-24, Jan. 2014.
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