Suchergebnisse

This work demonstrated a simple and environmentally friendly method for synthesizing silica-supported copper nanocubes (CuNCs/SiO2). The copper nanocubes, with a size of 15 ± 5 nm, were synthesized using green reagents and conditions. Ascorbic acid, water, and di-n-butyl sulfide were employed as reducing agent, solvent, and stabilizing ligand, respectively. The designed nanoscale catalyst was utilized for the esterification of acetic acid to methyl acetate at room temperature. The catalyst exhibited high efficiency, converting 80% of the reactant to the desired product (methyl acetate) after 24 hours of reaction at room temperature. The size and shape of copper nanocubes were characterized by transmission electron microscopy (TEM) and X-ray diffraction to characterize the formation of copper nanocubes, while the esterification product was characterized using gas chromatography-mass spectrometry.

A novel methodology was proposed, and optimized using the Design Expert software, aiming to enable characterization of the fatty acid profile of olives whilst abolishing the lipid extraction step. Furthermore, the proposed method was proven more efficient whereas requiring less time, and sample and solvent amounts, consequently improving process yield. Optimum conditions obtained after experimental design were as follows: sonication temperature and time of 60 ºC and 8 minutes, respectively, and concentrations for alkaline and acid reactions of 0.70 and 1.5 mol L-1, respectively. Total fatty acid content for olive sample was 172.0 mg g-1, the predicted value was and is in the coefficient of variation range of 11.52%

| openaire: EC/H2020/788489/EU//BioELCell Prof. Watson Loh and the São Paulo Research Foundation (FAPESP; grant no. 2016/13926-7) are acknowledged for granting access to LUMiSizer, and Caroline Silva for experimental support. This research was funded in part by the Austrian Science Fund (FWF) (J4356), FAPESP (grant no. 2019/00370-9), the Academy of Finland (Project #311255, 'WTF-Click-Nano') and the European Research Council (ERC) under the European Union's Horizon 2020 research and innovation program (grant agreement no. 788489). ; A new regioselective route is introduced for surface modification of biological colloids in the presence of water. Taking the case of cellulose nanofibers (CNFs), we demonstrate a site-specific (93% selective) reaction between the primary surface hydroxyl groups (C6-OH) of cellulose and acyl imidazoles. CNFs bearing C6-acetyl and C6-isobutyryl groups, with a degree of substitution of up to 1 mmol g(-1) are obtained upon surface esterification, affording CNFs of adjustable surface energy. The morphological and structural features of the nanofibers remain largely unaffected, but the regioselective surface reactions enable tailoring of their interfacial interactions, as demonstrated in oil/water Pickering emulsions. Our method precludes the need for drying or exchange with organic solvents for surface esterification, otherwise needed in the synthesis of esterified colloids and polysaccharides. Moreover, the method is well suited for application at high-solid content, opening the possibility for implementation inreactive extrusion and compounding. The proposed acylation is introduced as a sustainable approach that benefits from the presence of water and affords a high chemical substitution selectivity. ; Peer reviewed

[EN] Zirconium terephthalate UiO-66 type metal organic frameworks (MOFs) are known to be highly active, stable and reusable catalysts for the esterification of carboxylic acids with alcohols. Moreover, when defects are present in the structure of these MOFs, coordinatively unsaturated Zr ions with Lewis acid properties are created, which increase the catalytic activity of the resulting defective solids. In the present work, molecular modeling techniques combined with new experimental data on various defective hydrated and dehydrated materials allow to unravel the nature and role of defective active sites in the Fischer esterification and the role of coordinated water molecules to provide additional Bronsted sites. Periodic models of UiO-66 and UiO-66-NH2 catalysts have been used to unravel the reaction mechanism on hydrated and dehydrated materials. Various adsorption modes of water and methanol are investigated. The proposed mechanisms are in line with experimental observations that amino groups yield a reduction in the reaction barriers, although they have a passive role in modulating the electronic structure of the material. Water has a beneficial role on the reaction cycle by providing extra Bronsted sites and by providing stabilization for various intermediates through hydrogen bonds. (C) 2017 The Authors. Published by Elsevier Inc. ; This work is supported by the Fund for Scientific Research Flanders (FWO) (project number 3G048612), the Research Board of Ghent University (BOF) and BELSPO in the frame of IAP/7/05. This project has received funding from the European Union's Horizon 2020 research and innovation programme under the Marie Sklodowska-Curie grant agreement No. 641887 (project acronym: DEFNET). Funding was also received from the European Union's Horizon 2020 research and innovation programme [consolidator ERC grant agreement no. 647755-DYNPOR (2015-2020)]. Computational resources (Stevin Supercomputer Infrastructure) and services were provided by Ghent University. Financial support from the ...

Aims: The study is aimed to develop an indigenous heterogeneous based catalyst and evaluate kinetic mechanism for the synthesis of ethyl acetate by esterification of acetic acid and ethanol. Study Design: Batch reactor system. Place and Duration of Study: Department of Pure and Industrial Chemistry, Faculty of Science, University of Port Harcourt, Rivers State. Nigeria. The study was carried out between February to August, 2011. Methodology: A sample of the natural clay was collected from the open clay deposit in Ezinachi, Okigwe Local Government Area, Imo state, Nigeria. The clay sample was washed and dried under sunshine for two days. Titanium pillared bentonite was produced by modification of natural bentonite clay using titanium pillaring solution at 500ᶿC. X-Ray diffraction (XRD), Fourier Transform Infra-Red (FTIR) and BET gas sorption analysis were employed to characterize the pillared material. Esterification reactions were carried out in a batch mode using a three-necked round bottom glass flask of 250 ml capacity fitted with a reflux condenser and mercury in glass thermometer to monitor the temperature. Heating and stirring was achieved using a magnetic hot plate with a stirrer. Pre-determined amount of acetic acid (for 1:1, 2:1, 3:1, 4:1 acid: alcohol mole ratio) and the clay catalyst were charged into the reactor and heated to 90 ±0.5ºC. After the desired temperature has been reached, a known amount of ethanol preheated separately using heating mantle was added into the reactor. About 2 ml of the reaction mixture was taken immediately using Pasteur pipette and titrated against 0.1 M NaOH solution using phenolphthalein indicator. All the experimental runs were designed by varying the amount of the catalyst, the acid to alcohol mole ratios, and the reaction period to obtain various kinetic parameters while keeping the temperature constant for all the runs. Results: The result revealed that significant improvement on physicochemical characteristics of the bentonite samples occurred as a result of ...

401 414 352 ; S ; [EN] Zirconium terephthalate UiO-66 type metal organic frameworks (MOFs) are known to be highly active, stable and reusable catalysts for the esterification of carboxylic acids with alcohols. Moreover, when defects are present in the structure of these MOFs, coordinatively unsaturated Zr ions with Lewis acid properties are created, which increase the catalytic activity of the resulting defective solids. In the present work, molecular modeling techniques combined with new experimental data on various defective hydrated and dehydrated materials allow to unravel the nature and role of defective active sites in the Fischer esterification and the role of coordinated water molecules to provide additional Bronsted sites. Periodic models of UiO-66 and UiO-66-NH2 catalysts have been used to unravel the reaction mechanism on hydrated and dehydrated materials. Various adsorption modes of water and methanol are investigated. The proposed mechanisms are in line with experimental observations that amino groups yield a reduction in the reaction barriers, although they have a passive role in modulating the electronic structure of the material. Water has a beneficial role on the reaction cycle by providing extra Bronsted sites and by providing stabilization for various intermediates through hydrogen bonds. (C) 2017 The Authors. Published by Elsevier Inc. This work is supported by the Fund for Scientific Research Flanders (FWO) (project number 3G048612), the Research Board of Ghent University (BOF) and BELSPO in the frame of IAP/7/05. This project has received funding from the European Union's Horizon 2020 research and innovation programme under the Marie Sklodowska-Curie grant agreement No. 641887 (project acronym: DEFNET). Funding was also received from the European Union's Horizon 2020 research and innovation programme [consolidator ERC grant agreement no. 647755-DYNPOR (2015-2020)]. Computational resources (Stevin Supercomputer Infrastructure) and services were provided by Ghent University. Financial support ...