Phthalic anhydride is an important organic chemical raw material, widely used in the synthesis of phthalate plasticizers and in resin production, and can also be used to prepare dyes and pharmaceutical intermediates, pesticides and plastic additives, food additives, fragrances, etc. Phthalic anhydride is modeled as a pure substance; when modeling this substance, users need to add a solvent of their choice to the model. This dataset includes the main raw and auxiliary materials, energy, waste and atmospheric emissions of the production process, in which the wastewater preliminary treatment in the utility processes and the waste gas treatment process are included within the dataset boundary, the by-product high pressure steam is partly reused in production, while infrastructure such as the manufacture of production equipment and plant construction is not included within the dataset boundary; the inventory is formed by merging data from multiple sources; the production activities of this product include naphthalene refining, oxidation reaction, condensation recovery, phthalic anhydride refining, steam recovery and other process steps. High pressure steam is a by-product of this production process.