三有机锡催化剂催化蓖麻油转化为生物柴油:色谱和光谱表征及理论支持

Q4 Agricultural and Biological Sciences Proceedings of the Pakistan Academy of Sciences: Part B Pub Date : 2023-06-24 DOI:10.53560/ppasb(60-2)816
Nousheen Mustafa, Muhammad Zubair, Noor Uddin, Saqib Ali, Ali Haider, Amin Badshah
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引用次数: 0

摘要

对化石燃料储量的经济关注、二氧化碳排放的广泛增加以及碳源燃烧导致的世界气候变化,促使商业和学术研究人员关注新的可持续燃料路线,以满足快速增长的全球人口需求。在本研究中,我们重点研究了催化酯交换法合成环境友好型生物柴油,这是一种低成本,易于实现的化石燃料的最佳替代来源。本文按照本研究的方法合成了三有机锡(IV)羧酸衍生物三甲基锡基环戊烷羧酸酯、三丁基锡基环戊烷羧酸酯和三苯基锡基环戊烷羧酸酯,并以LANL2DZ为泛函,以B3LYP基集(理论水平)计算分子静电势(MEP),确定配合物的亲电中心和Lewis酸度,通过DFT进行了理论研究。由于所合成的配合物具有Lewis酸的性质,将其用作蓖麻油酯交换反应的催化剂。并对不同的反应参数进行了优化,以获得最大的生物柴油产率。采用多光谱技术对合成的蓖麻油生物柴油(COB)进行了表征和鉴定。本研究评估了这些配合物可以从不可食用和廉价的原料转化为生物柴油的潜在候选物。
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Catalytic Conversion of Castor Oil into Biodiesel by Tri-organotin(IV) Catalysts: Chromatographic and Spectroscopic Characterization with Theoretical Support
Economic concern over fossil fuel reserves, extensive increase in CO2 emission, and change in the world climate due to the combustion of carbon sources have been driving the attention of both commercial and academic researchers towards new sustainable fuel routes to encounter rapidly growing worldwide population demands. In the present study, we have focused on catalytic transesterification towards the environmentally friendly biodiesel synthesis which is low cost, easily implemented and best alternative source of fossil fuels. Herein three triorganotin(IV) carboxylates derivatives namely trimethylstannyl cyclopentanecarboxylate, tributylstannyl cyclopentanecarboxylate and triphenylstannyl cyclopentanecarboxylate were resynthesized according to our reported procedure and theoretically investigated through DFT by applying LANL2DZ as functional with B3LYP basis set (level of theory) to calculate Molecular Electrostatic Potential (MEP) to determine electrophilic center of complexes and Lewis acidity. Owing to the Lewis acid character, the synthesized complexes were then used as catalysts in the transesterification reaction of castor oil. Different reaction parameters were also optimized to obtain maximum biodiesel yield. Synthesized castor oil biodiesel (COB) was characterized and confirmed by employing multitude spectroscopic techniques. The present study evaluated that these complexes can be potential candidates for biodiesel conversion from non-edible and cheap feedstock.
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Proceedings of the Pakistan Academy of Sciences: Part B
Proceedings of the Pakistan Academy of Sciences: Part B Agricultural and Biological Sciences-Agricultural and Biological Sciences (all)
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