In this study, the solid−liquid phase equilibrium of the ternary adenine (C 5 H 5 N 5 ) + hydrogen peroxide (H 2 O 2 ) + water (H 2 O) system at 283.15 and 293.15 K under atmospheric pressure (p = 101.1 kPa) was determined using the isothermal saturation methodology. The solubility data of adenine in various concentrations of hydrogen peroxide solutions were determined, and two ternary phase diagrams were built using the wet residue method of Schreinemakers. At a certain temperature, two pure solids corresponding to pure adenine and pure C 5 H 5 N 5 •H 2 O 2 adduct appeared in each equilibrium system. As the temperature dropped, the saturated areas of pure C 5 H 5 N 5 •H 2 O 2 adduct and adenine increased. Under the same conditions, the saturated region of the C 5 H 5 N 5 •H 2 O 2 adduct was significantly larger than that of adenine. In addition, the C 5 H 5 N 5 •H 2 O 2 adduct produced based on the ternary phase diagram of C 5 H 5 N 5 + H 2 O 2 + H 2 O was characterized by infrared spectra, X-ray powder diffraction, thermogravimetry, and morphology. In addition, the influence of ethanol upon the solid−liquid phase equilibrium was investigated. Addition of ethanol increases the solubility of adenine and C 5 H 5 N 5 •H 2 O 2 adduct.