The present study is an ini�al pre-screen of a mul�level study aiming at ra�onal design for high-performance SAF from the PtL pathway [2]. The selected high-performance PCHCs will be studied quantum mechanically using DFT calcula�ons for their quan�ta�ve structureproperty rela�onship (QSPR) to iden�fy suitable SAF candidates, followed by synthesis reac�on pathway and catalyst development, and finalized with a techno-economic assessment (TEA) for feasibility and costs associated.