In situ hydrolysis for dihydroxystearic acid production from catalytic epoxidation of oleic acid

IF 1.9 4区 工程技术 Q3 ENGINEERING, CHEMICAL
Ismail Md. Rasib, Intan Suhada Azmi, Mohd Jumain Jalil
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Abstract

Concern regarding the setback of dependency on using fossil fuels as the main resources as the precursor for many derivatives had drawn attention to further study the production of dihydroxystearic acid (DHSA) by in situ hydrolysis of epoxidized oleic acid. Epoxidized oleic acid was produced by using in situ formed performic acid. Performic acid was formed by mixing formic acid as the oxygen carrier with hydrogen peroxide as the oxygen donor. The Taguchi method had proposed that optimum parameter for DHSA production is hydrogen peroxide/oleic acid unsaturation molar ratio of 1.5:1, formic acid/oleic acid unsaturation molar ratio of 0.5, reaction temperature of 35°C, and agitation speed of 200 rpm. Based on the optimized parameters, the highest DHSA hydroxyl value of 267 mg KOH/g was achieved. Additionally, a mathematical model was developed using MATLAB software, employing the fourth-order Runge–Kutta method and simulated annealing optimization to accurately describe the kinetic behaviour of the reaction. The numerical simulations were performed using a genetic algorithm, and the results showed good agreement between the simulation and experimental data, which validates the kinetic model.

Abstract Image

油酸催化环氧化原位水解制备二羟基硬脂酸
考虑到依赖化石燃料作为许多衍生物前体的主要资源的阻碍,人们注意到进一步研究环氧化油酸原位水解生产二羟基硬脂酸(DHSA)。采用原位生成的高性能甲酸制备了环氧化油酸。以甲酸为载氧剂,过氧化氢为供氧剂,混合制备了过甲酸。Taguchi法提出制备DHSA的最佳工艺参数为:过氧化氢/油酸不饱和摩尔比为1.5:1,甲酸/油酸不饱和摩尔比为0.5,反应温度35℃,搅拌转速200 rpm。在此基础上,优化后的DHSA羟基值最高为267 mg KOH/g。此外,利用MATLAB软件建立了数学模型,采用四阶龙格-库塔法和模拟退火优化来准确描述反应的动力学行为。采用遗传算法进行了数值模拟,仿真结果与实验数据吻合较好,验证了动力学模型的正确性。
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来源期刊
Canadian Journal of Chemical Engineering
Canadian Journal of Chemical Engineering 工程技术-工程:化工
CiteScore
3.60
自引率
14.30%
发文量
448
审稿时长
3.2 months
期刊介绍: The Canadian Journal of Chemical Engineering (CJChE) publishes original research articles, new theoretical interpretation or experimental findings and critical reviews in the science or industrial practice of chemical and biochemical processes. Preference is given to papers having a clearly indicated scope and applicability in any of the following areas: Fluid mechanics, heat and mass transfer, multiphase flows, separations processes, thermodynamics, process systems engineering, reactors and reaction kinetics, catalysis, interfacial phenomena, electrochemical phenomena, bioengineering, minerals processing and natural products and environmental and energy engineering. Papers that merely describe or present a conventional or routine analysis of existing processes will not be considered.
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