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Theoretical analysis of hydrogen solubility in direct coal liquefaction solvents

International Journal of Coal Science & Technology 2024年第2期11卷 187-197页

作者： Xiaobin Zhang Aoqi Wang Xingbao Wang Wenying Li State Key Laboratory of Clean and Efficient Coal Utilization Taiyuan University of TechnologyTaiyuan 030024ShanxiChina College of Chemical Engineering and Technology Taiyuan University of TechnologyTaiyuan 030024China

The cyclic hydrogenation technology in a direct coal liquefaction process relies on the dissolved hydrogen of the solvent or oil participating in the hydrogenation ***,a theoretical basis for process optimization and reactor design can be established by analyzing the solubility of hydrogen in liquefaction *** studies of hydrogen solubility in liquefaction solvents are challenging due to harsh reaction conditions and complex solvent *** this study,the composition and content of liquefied solvents were *** model compounds,hexadecane,toluene,naphthalene,tetrahydronaphthalene,and phenanthrene were chosen to represent the liquefied solvents in chain alkanes and monocyclic,bicyclic,and tricyclic aromatic *** solubility of hydrogen X(mol/mol)in pure solvent components and mixed solvents(alkanes and aromatics mixed in proportion to the chain alkanes+bicyclic aromatic hydrocarbons,bicyclic saturated aromatic hydrocarbons+bicyclic aromatic hydrocarbons,and bicyclic aromatic hydrocarbons+compounds containing het-eroatoms composed of mixed components)are determined using Aspen simulation at temperature and pressure conditions of 373–523 K and 2–10 *** results demonstrated that at high temperatures and pressures,the solubility of hydrogen in the solvent increases with the increase in temperature and pressure,with the pressure having a greater ***-more,the results revealed that hydrogen is more soluble in straight-chain alkanes than in other solvents,and the solubility of eicosanoids reaches a maximum of *** hydrogen solubility in aromatic ring compounds decreased gradually with an increase in the aromatic ring *** influence of chain alkanes on the solubility of hydrogen predominates in a mixture of solvents with different mixing ratios of chain alkanes and aromatic *** solubility of hydrogen in mixed aromatic solvents is less than that in the corresponding single ***

关键词： Direct coal liquefaction liquefaction solvents Process simulation Hydrogen solubility

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