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ipriflavone
JOURNAL OF CHEMICAL THERMODYNAMICS · 2020 · IF 2.888

Solubility measurement, model evaluation and Hansen solubility parameter of ipriflavone in three binary solvents

Zibo Huang,Jiao Sha,Yingge Chang,Zidan Cao,Xiaoran Hu,Yu Li,Tao Li,Baozeng Ren

Ipriflavone is a drug widely used in clinical treatment and prevention of osteoporosis, and it also has a certain protective effect on the nervous system. In this work, the laser dynamic method was used to measure the solubility data of IP in three binary solvents under normal pressure (temperature range: 278.15 K to 323.15 K). The results show that as both the mass fraction of positive solvents (NMP, DMF, DMAC) in the binary mixed solvents and the temperature increase, the solubility of IP increases. In addition, the Hansen solubility parameter (HSP) was used to analyze the order of solubility. The results indicated that the selected solubility parameters (Δ δ d , Δ δ p , Δ δ h , Δ δ t and Δ δ ) could explain the solubility trend well. Furthermore, the modified Apelblat equation, λH equation, NRTL model and UNIQUAC model were used to correlate the solubility data in binary mixed solvents. By calculating the deviation between the experimental data and the fitting data, it shows that the selected models have a good correlation with the solubility data of IP. Finally, the modified van’t Hoff equation was used to calculate the apparent thermodynamic properties of IP during the dissolution process . The results show that the dissolution process is always endothermic and entropy driven.

CAS / MDL: 35212-22-7
研究领域: 药物化学 · 物理化学
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JOURNAL OF CHEMICAL THERMODYNAMICS · 2020 · IF 2.888

Solid-liquid equilibrium solubility, thermodynamic properties, solvent effect of Ipriflavone in twelve pure solvents at various temperatures

Zibo Huang,Yuanyuan Zun,Yi Gong,Xiaoran Hu,Jiao Sha,Yu Li,Tao Li,Baozeng Ren

In this study, by using laser dynamic monitoring, the dissolution behavior of ipriflavone (IP) in pure solvents of methanol, ethanol, n-propanol, n-butyl alcohol, 1-pentanol, methyl acetate, DMF, DMAC, acetone, acetonitrile, methylbenzene at (278.15–323.15) K and dichloromethane at (278.15–308.15) K was investigated under 0.1 MPa. The results showed that the molar solubility of IP in pure solvents increases non-linearly with the increase of the experimental temperature. The order of the solubility of IP in the pure solvents studied is: dichloromethane > DMAC > DMF > methylbenzene > methyl acetate > acetone > acetonitrile > 1-pentanol > n-butyl alcohol > n-propanol > ethanol > methanol. Moreover, experimental solubility data were correlated well with five thermodynamic models (Apelblat, λH, NRTL, UNIQUAC, and Van't hoff model). The calculation results showed that the Apelblat model has the smallest average values of the relative deviation ( ARD ) and root mean square deviation (10 4 RMSD ), being 1.878% and 2.933, respectively. Furthermore, the influence of solvent–solute interactions on the solubility of IP in pure solvents was analyzed by using the KAT-LSER model. In addition, the apparent thermodynamic properties(△ sol G °, △ sol H °, △ sol S °) of IP in pure solvents were calculated by correlating experimental solubility data with the Van't hoff model. The results show that the dissolution process of IP in the experimental solvents was endothermic and entropy-driven.

CAS / MDL: 35212-22-7
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