Densities, viscosities, and refractive indices of binary mixtures of tri-n-butyl phosphate with propan-2-ol and butan-2-ol at 303.15, 308.15, 313.15, 318.15, and 323.15 K

IF 2.2 3区 工程技术 Q3 CHEMISTRY, PHYSICAL Journal of Chemical Thermodynamics Pub Date : 2023-12-29 DOI:10.1016/j.jct.2023.107247
Iqbal Hossen , M. Mehedi Hasan Rocky , M. Riyad , M. Masum Billah , Ismail M.M. Rahman , Shamim Akhtar
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Abstract

Densities, viscosities, and refractive indices of binary liquid mixtures of tri-n-butyl phosphate (TBP) with propan-2-ol and butan-2-ol at different temperatures between 303.15 and 323.15 K at an interval of 5 K and across the entire range of composition were measured. The data were used to calculate derived properties, such as excess molar volumes, excess thermal expansivities, deviations in viscosities, excess free energies of activation for viscous flow, and deviations in refractive index. The variation patterns of these properties concerning composition and temperature for the propan-2-ol + and butan-2-ol + TBP systems were discussed and attributed to probable intermolecular hydrogen bonding and geometric effects. Notably, the influence of hydrogen bonding was substantial, as evidenced by trends in excess molar volumes and deviations in viscosities. Concentration-dependent polynomial equations were used to fit the measured data of density, viscosity, and refractive index, while Redlich-Kister-type equations were applied for the excess properties. The densities and viscosities were correlated using the Jouyban-Acree model. The correlating abilities of various models, such as Grunberg-Nissan, Tamura-Kurata, Heric, Ausländer, McAllister-3, and McAllister-4 body models, were also evaluated using the viscosity data. Additionally, six new pairs of UNIFAC-VISCO group interaction parameters were computed to predict viscosities of TBP in systems involving alkanes, aromatics, and alcohols, extending the application range of the group contribution model.

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磷酸三正丁酯与丙-2-醇和丁-2-醇的二元混合物在 303.15、308.15、313.15、318.15 和 323.15 K 下的密度、粘度和折射率
测量了磷酸三正丁酯(TBP)与丙-2-醇和丁-2-醇的二元液体混合物在 303.15 至 323.15 K 之间不同温度下的密度、粘度和折射率,间隔时间为 5 K,并跨越整个组成范围。这些数据用于计算衍生特性,如过量摩尔体积、过量热膨胀系数、粘度偏差、粘性流动的过量活化自由能和折射率偏差。讨论了丙-2-醇 + 和丁-2-醇 + TBP 体系的这些特性随组成和温度的变化规律,并将其归因于可能的分子间氢键和几何效应。值得注意的是,氢键的影响很大,过剩摩尔体积的趋势和粘度的偏差都证明了这一点。与浓度相关的多项式方程用于拟合密度、粘度和折射率的测量数据,而 Redlich-Kister 型方程则用于拟合过量特性。使用 Jouyban-Acree 模型分析了密度和粘度的温度依赖性。还利用粘度数据评估了各种模型的相关能力,如 Grunberg-Nissan、Tamura-Kurata、Heric、Ausländer、McAllister-3 和 McAllister-4 体模型。此外,还计算了六对新的 UNIFAC-VISCO 组相互作用参数,以预测涉及烷烃、芳烃和醇类的体系中 TBP 的粘度,从而扩大了组贡献模型的应用范围。
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来源期刊
Journal of Chemical Thermodynamics
Journal of Chemical Thermodynamics 工程技术-热力学
CiteScore
5.60
自引率
15.40%
发文量
199
审稿时长
79 days
期刊介绍: The Journal of Chemical Thermodynamics exists primarily for dissemination of significant new knowledge in experimental equilibrium thermodynamics and transport properties of chemical systems. The defining attributes of The Journal are the quality and relevance of the papers published. The Journal publishes work relating to gases, liquids, solids, polymers, mixtures, solutions and interfaces. Studies on systems with variability, such as biological or bio-based materials, gas hydrates, among others, will also be considered provided these are well characterized and reproducible where possible. Experimental methods should be described in sufficient detail to allow critical assessment of the accuracy claimed. Authors are encouraged to provide physical or chemical interpretations of the results. Articles can contain modelling sections providing representations of data or molecular insights into the properties or transformations studied. Theoretical papers on chemical thermodynamics using molecular theory or modelling are also considered. The Journal welcomes review articles in the field of chemical thermodynamics but prospective authors should first consult one of the Editors concerning the suitability of the proposed review. Contributions of a routine nature or reporting on uncharacterised materials are not accepted.
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