Alkyladamantanes
(AAs) are the ideal candidates for high energy
density fuels for aviation propulsion due to their high density, high
calorific values, and good low-temperature performance. However, the
reaction process of AAs through the hydroisomerization of related
polycyclic aromatic hydrocarbons (PAHs) remained unclear. This study
focuses on investigating the hydroisomerization process of acenaphthene
as a representative PAH using Pt/USY catalysts. To enhance the highest
yield of the C12 AAs, USY zeolites were demetallized to enhance the
diffusion and adjust the acidity. Additionally, the isomerization
process of perhydroacenaphthene (PHA) was studied to examine the impact
of different conformations of fully hydrogenated species. It was observed
that the tiled trans–trans–trans conformation was more
easily isomerized to AAs, likely catalyzed by multiple active sites.
Based on the reaction network of anthracene, phenanthrene, and fluorene,
the ability to form the perhydrophenalene type tricyclic structure
was a necessary condition for the hydroisomerization of PAHs to AAs.