Thermodynamic study for the (butyl, hexyl and octyl) acetoacetate under high pressure CO2

Abstract

Understanding the phase behavior of binary liquid mixtures containing butyl acetoacetate, hexyl acetoacetate, and octyl acetoacetate under high-pressure supercritical CO2 (sc-CO2) is essential for several applications. The solubility curves for these binary mixtures have been investigated at different temperature and pressure ranges, specifically between 313.2 K and 393.2 K and 2.39 MPa to 23.83 MPa. The three systems, namely butyl acetoacetate, hexyl acetoacetate, and octyl acetoacetate in high-pressure sc-CO2, exhibit critical mixture curves and a maximum in pressure–temperature (P, T) diagrams between the critical point of butyl acetoacetate/hexyl acetoacetate/octyl acetoacetate and carbon dioxide. These characteristics of the critical mixture plot fall under the category of type-I behavior.The Peng-Robinson equation, which utilizes van der Waals mixing rules and two interaction parameters, is employed to correlate experimental solubility curves and critical mixture curves of the aforementioned three systems. The root mean square deviation percentage (RMSD%) is calculated at each temperature (using temperature-dependent adjusted parameters) for the butyl acetoacetate + sc-CO2, hexyl acetoacetate + sc-CO2, and octyl acetoacetate + sc-CO2 systems, and it ranges from 3.11% to 5.92%, 2.09% to 3.97%, and 1.70% to 3.02%, respectively.

Keywords

• Butyl acetoacetate
• High pressure
• Hexyl acetoacetate
• Octyl acetoacetate
• Phase behavior
• Supercritical CO2