Journal
ARABIAN JOURNAL OF CHEMISTRY
Volume 14, Issue 5, Pages -Publisher
ELSEVIER
DOI: 10.1016/j.arabjc.2021.103141
Keywords
Biodiesel; Triglyceride transesterification; Montmorillonite; LiAlH4 hydrolysates; DFT calculations
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Funding
- Consejo Nacional de Ciencia y Tecnologia (CONACYT)
- Secretaria de Energia (SENER) [Y.60014]
- Fondo Sectorial CONACYT-SECRETARIA DE ENERGIA SUSTENTABILIDAD ENERGETICA, Demand for Renewable Energies
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Transesterification catalysts prototypes based on LiAlP/montmorillonite were successfully synthesized from LiAlH4 hydrolysates. The extruded catalysts maintained the basic structure of montmorillonite K10, leading to high conversion rates of palm oil triglycerides to FAMEs. Computational studies revealed the importance of Lewis acid sites and mesoporous structures in the catalytic activity, as well as the electrophilicity behavior of the reactants.
Transesterification catalysts prototypes of LiAlP/montmorillonite from LiAlH4 hydrolysates (LiOH-Al(OH)(3)) have been synthesized and extruded. The extruded catalysts preserve the basic structure of montmorillonite K10 according to X-ray diffraction results, which promote transesterification of triglycerides present in palm oil with methanol to generate FAMEs. Palm oil conversions of up to 89.7% were achieved in a batch reactor at 200 degrees C, 40 Kg/cm(2), and MeOH:Oil molar ratio of 18:1. The results obtained suggest that the good catalytic activity of the extrudates is due to the adequate combination of the Lewis acid sites and the mesoporous structure obtained during the reaction between the montmorillonite, phosphoric acid and LiOH-Al(OH)(3). By mean of B3LYP/6-31G* calculations, the behavior of the electrophilicity for the palm oil triglycerides and the corresponding H, Li and Al cations is remarkable, the highest electrophilicity for cation is in this order: H > Al > Li and more important for triglyceride aluminum cation in which palmitoyl moiety is in the methine carbon of glycerol moiety. (C) 2021 The Author(s). Published by Elsevier B.V. on behalf of King Saud University.
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