Isophthalic acid is commonly used in the production of high polymers such as unsaturated polyester resins and alkyd resins and plasticizers, and is also used in coatings, inks, dyeing modifiers and pharmaceutical synthesis and other fields. Isophthalic acid 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, the waste gas treatment process and the solid-waste incineration treatment process are included within the dataset boundary, 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 oxidation reaction, crystallization separation, drying, solvent recovery and other process steps.