Liquid organic hydrogen carriers: Process design and economic analysis for manufacturing N‐ethylcarbazole

E. M. T. Uijthof, B. S. Chavan, M. J. Sluijer, V. C. Komath, A. G. J. van der Ham, H. van den Berg, J.‐P. Lange, A. Higler, S. Wijnans
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Abstract

This paper revisits the economics of manufacturing N‐ethylcarbazole (NEC), a strong candidate for large‐scale liquid organic hydrogen carrier (LOHC) supply chains, because of its high H2 storage capacity (6 wt%), selective hydrogenation and dehydrogenation reactions, and favorable reaction enthalpy and reaction temperatures compared to other LOHC systems. Two different process routes for producing NEC from industrial chemicals are selected out of 10 possible options: one using aniline and the other using cyclohexanone and nitrobenzene as feedstock. The required capital and operational costs are estimated to determine a NEC break‐even cost for a capacity of 225 ktpa. NEC break‐even costs of $3.0 and $2.6 per kg LOHC are found for the routes. This is significantly less than the $40/kg cost that has generally been reported in literature for NEC, thus improving the economic viability of using NEC as LOHC. The total fixed capital costs are estimated to be $200 MM and $250 MM. Furthermore, the prices of the feedstock show the largest influence (76% and 72%) on the final NEC break‐even costs. The overall LOHC price contribution to the levelized H2 cost is estimated to be $0.77–$0.90 per kg H2 for a 60‐day roundtrip and $0.09–$0.10 per kg H2 for a 7‐day roundtrip. It is important to note that both routes rely heavily on laboratory scale data and the corresponding assumptions that stem from this limitation. Therefore, this research can serve as a guide to future experimental studies into validating the key assumptions made for this analysis.
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液态有机氢载体:制造 N-乙基咔唑的工艺设计和经济分析
本文重新探讨了制造 N-乙基咔唑(NEC)的经济性,NEC 是大规模液态有机氢载体(LOHC)供应链的有力候选者,因为与其他 LOHC 系统相比,NEC 具有高 H2 储存能力(6 wt%)、选择性氢化和脱氢反应以及有利的反应热焓和反应温度。从 10 种可能的方案中选出了两种从工业化学品生产 NEC 的不同工艺路线:一种使用苯胺,另一种使用环己酮和硝基苯作为原料。对所需的资本和运营成本进行了估算,以确定年产 225 ktpa 的 NEC 盈亏平衡成本。结果发现,这些路线的 NEC 盈亏平衡成本分别为每公斤 LOHC 3.0 美元和 2.6 美元。这大大低于文献中普遍报道的每公斤 40 美元的 NEC 成本,从而提高了使用 NEC 作为 LOHC 的经济可行性。据估计,固定资本总成本分别为 2 亿美元和 2.5 亿美元。此外,原料价格对最终 NEC 盈亏平衡成本的影响最大(分别为 76% 和 72%)。据估计,60 天往返的 LOHC 价格对平准化 H2 成本的总体影响为每公斤 H2 0.77 美元至 0.90 美元,7 天往返的 LOHC 价格对平准化 H2 成本的总体影响为每公斤 H2 0.09 美元至 0.10 美元。值得注意的是,这两条路线都严重依赖实验室规模的数据以及由此产生的相应假设。因此,本研究可作为未来实验研究的指南,以验证本分析的关键假设。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
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