Autocatalytic Acetylation of Crude Glycerol Using Acetic Acid: A Kinetic Model

The aim of this work was to develop a kinetic model based on the power law to describe the evolution of glycerol conversion and product distribution in the crude glycerol (G) acetylation reaction with acetic acid (AA) without the use of a catalyst. For this purpose, experimental tests were carried o...

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Published in:Reactions
Main Authors: Federico M. Perez, Francisco Pompeo, Gerardo F. Santori, Martín N. Gatti
Format: Article
Language:English
Published: MDPI AG 2024-08-01
Subjects:
Online Access:https://www.mdpi.com/2624-781X/5/3/25
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author Federico M. Perez
Francisco Pompeo
Gerardo F. Santori
Martín N. Gatti
author_facet Federico M. Perez
Francisco Pompeo
Gerardo F. Santori
Martín N. Gatti
author_sort Federico M. Perez
collection DOAJ
container_title Reactions
description The aim of this work was to develop a kinetic model based on the power law to describe the evolution of glycerol conversion and product distribution in the crude glycerol (G) acetylation reaction with acetic acid (AA) without the use of a catalyst. For this purpose, experimental tests were carried out with analytical glycerol under different reaction conditions (T = 80–160 °C, AA/G = 1–9 molar ratio, t = 0.25–2 h). The results showed the formation of mono- (MAG), di- (DAG) and tri- (TAG) acetylglycerols, liquid products with multiple applications in the chemical industry. From these results, a kinetic model based on the power law was implemented, which could acceptably estimate the experimental concentrations with an average relative error of 14.9%. Then, crude glycerol samples from different biodiesel industries were characterized by identifying and quantifying the impurities present in them (H<sub>2</sub>O, CH<sub>3</sub>OH, NaOH, NaCOOH, MONG and NaCl), and employed as reactants in the reaction tests. Given the significant differences observed in the glycerol conversion values compared to those obtained with analytical glycerol, further reaction tests were conducted to elucidate the effect of each impurity over the glycerol conversion. In these tests, the different impurities were added individually, maintaining the same concentration range as that of the crude glycerol samples. From the results obtained, global activity factors were introduced, which allowed us to modify the kinetic model to estimate glycerol conversions in the crude glycerol samples with an average relative error of 7%. It is hoped that this kinetic model will be a powerful tool useful for designing reactors on an industrial scale.
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spelling doaj-art-e9d900aa0fd1452792205dddb5e47bcf2025-08-19T23:10:58ZengMDPI AGReactions2624-781X2024-08-015347249110.3390/reactions5030025Autocatalytic Acetylation of Crude Glycerol Using Acetic Acid: A Kinetic ModelFederico M. Perez0Francisco Pompeo1Gerardo F. Santori2Martín N. Gatti3Centro de Investigación y Desarrollo en Ciencias Aplicadas (CINDECA), Facultad de Ciencias Exactas, Universidad Nacional de La Plata (UNLP)—CONICET, Calle 47, 257, La Plata 1900, ArgentinaCentro de Investigación y Desarrollo en Ciencias Aplicadas (CINDECA), Facultad de Ciencias Exactas, Universidad Nacional de La Plata (UNLP)—CONICET, Calle 47, 257, La Plata 1900, ArgentinaCentro de Investigación y Desarrollo en Ciencias Aplicadas (CINDECA), Facultad de Ciencias Exactas, Universidad Nacional de La Plata (UNLP)—CONICET, Calle 47, 257, La Plata 1900, ArgentinaCentro de Investigación y Desarrollo en Ciencias Aplicadas (CINDECA), Facultad de Ciencias Exactas, Universidad Nacional de La Plata (UNLP)—CONICET, Calle 47, 257, La Plata 1900, ArgentinaThe aim of this work was to develop a kinetic model based on the power law to describe the evolution of glycerol conversion and product distribution in the crude glycerol (G) acetylation reaction with acetic acid (AA) without the use of a catalyst. For this purpose, experimental tests were carried out with analytical glycerol under different reaction conditions (T = 80–160 °C, AA/G = 1–9 molar ratio, t = 0.25–2 h). The results showed the formation of mono- (MAG), di- (DAG) and tri- (TAG) acetylglycerols, liquid products with multiple applications in the chemical industry. From these results, a kinetic model based on the power law was implemented, which could acceptably estimate the experimental concentrations with an average relative error of 14.9%. Then, crude glycerol samples from different biodiesel industries were characterized by identifying and quantifying the impurities present in them (H<sub>2</sub>O, CH<sub>3</sub>OH, NaOH, NaCOOH, MONG and NaCl), and employed as reactants in the reaction tests. Given the significant differences observed in the glycerol conversion values compared to those obtained with analytical glycerol, further reaction tests were conducted to elucidate the effect of each impurity over the glycerol conversion. In these tests, the different impurities were added individually, maintaining the same concentration range as that of the crude glycerol samples. From the results obtained, global activity factors were introduced, which allowed us to modify the kinetic model to estimate glycerol conversions in the crude glycerol samples with an average relative error of 7%. It is hoped that this kinetic model will be a powerful tool useful for designing reactors on an industrial scale.https://www.mdpi.com/2624-781X/5/3/25glycerol acetylationcrude glycerolbiodieselkinetic modelbiorefineries
spellingShingle Federico M. Perez
Francisco Pompeo
Gerardo F. Santori
Martín N. Gatti
Autocatalytic Acetylation of Crude Glycerol Using Acetic Acid: A Kinetic Model
glycerol acetylation
crude glycerol
biodiesel
kinetic model
biorefineries
title Autocatalytic Acetylation of Crude Glycerol Using Acetic Acid: A Kinetic Model
title_full Autocatalytic Acetylation of Crude Glycerol Using Acetic Acid: A Kinetic Model
title_fullStr Autocatalytic Acetylation of Crude Glycerol Using Acetic Acid: A Kinetic Model
title_full_unstemmed Autocatalytic Acetylation of Crude Glycerol Using Acetic Acid: A Kinetic Model
title_short Autocatalytic Acetylation of Crude Glycerol Using Acetic Acid: A Kinetic Model
title_sort autocatalytic acetylation of crude glycerol using acetic acid a kinetic model
topic glycerol acetylation
crude glycerol
biodiesel
kinetic model
biorefineries
url https://www.mdpi.com/2624-781X/5/3/25
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AT martinngatti autocatalyticacetylationofcrudeglycerolusingaceticacidakineticmodel