Jouyban A, Chew N Y K, Chan H K, Khoubnasabjafari M, Acree W E
Faculty of Pharmacy, Tabriz University of Medical Sciences, Tabriz 51664, Iran.
Pharmazie. 2006 Apr;61(4):318-21.
To show the applicability of a solution model, i.e. the Jouyban-Acree model, for predicting the solubility of a solute in ternary solvent systems based on model constants computed using solubility data of the solute in binary solvent systems, the solubility of salicylic acid in water-ethanol, water-propylene glycol, ethanol-propylene glycol mixtures was determined. A minimum number of three data points from each binary system was used to calculate the binary interaction parameters of the model. Then the solubility in other binary solvent compositions and also in a number of ternary solvents was predicted, and the mean percentage deviation (MPD) was calculated as an accuracy criterion. The overall MPD (+/-SD) was 7.3 (+/-7.3)% and those of a similar predictive model was 15.7 (+/-11.5)%. The mean difference between the proposed and a previous model was statistically significant (paired t-test, p < 0.004).
为了展示一种溶液模型(即Jouyban-Acree模型)基于利用溶质在二元溶剂体系中的溶解度数据计算得到的模型常数来预测溶质在三元溶剂体系中溶解度的适用性,测定了水杨酸在水-乙醇、水-丙二醇、乙醇-丙二醇混合物中的溶解度。每个二元体系至少使用三个数据点来计算模型的二元相互作用参数。然后预测在其他二元溶剂组成以及多种三元溶剂中的溶解度,并计算平均百分偏差(MPD)作为准确性标准。总体MPD(±标准差)为7.3(±7.3)%,而类似预测模型的MPD为15.7(±11.5)%。所提出的模型与先前模型之间的平均差异具有统计学意义(配对t检验,p < 0.004)。