Silvia J. R. Vargas, Thaís S. Soares, Filipe H. B. Sosa and Maria C. Hespanhol*,
{"title":"Reverse Pluronic 10R5-Based Aqueous Biphasic Systems with Ammonium Salts: A Novel Platform for Phenolic Compound Partitioning","authors":"Silvia J. R. Vargas, Thaís S. Soares, Filipe H. B. Sosa and Maria C. Hespanhol*, ","doi":"10.1021/acs.jced.5c00298","DOIUrl":"https://doi.org/10.1021/acs.jced.5c00298","url":null,"abstract":"<p >The valorization of lignocellulosic biomass is essential for developing sustainable bioprocesses and producing high-value compounds such as phenolics. However, the efficient separation of these compounds remains challenging due to their structural diversity. This study explored the use of aqueous biphasic systems (ABS) composed of poly(propylene glycol)-<i>block</i>-poly(ethylene glycol)-<i>block</i>-poly(propylene glycol), Pluronic 10R5, and different biodegradable ammonium salts (acetate, tartrate, and citrate) for the extraction of phenolic compounds. Phase diagrams were constructed at three temperatures (289.2, 298.2, and 313.2 K) and characterized by the binodal curve, tie-line length, and slope of the tie-line, with phase inversion phenomena observed for the first time in reverse Pluronic-based systems. The system with ammonium citrate exhibited the best performance in terms of extraction efficiency, biodegradability, and pH compatibility, resulting in stable phenolic compound stability. Five model compounds were evaluated, yielding partition coefficients ranging from 3.5 to 6.5 and extractions exceeding 80% in the polymer-rich phase. These findings demonstrate the potential of sustainable ABS as an effective platform for selective recovery processes in lignocellulosic biorefineries.</p>","PeriodicalId":42,"journal":{"name":"Journal of Chemical & Engineering Data","volume":"70 8","pages":"3332–3343"},"PeriodicalIF":2.1,"publicationDate":"2025-07-16","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://pubs.acs.org/doi/pdf/10.1021/acs.jced.5c00298","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"144826199","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"工程技术","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"OA","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
{"title":"Solubility Determination of Ammonium Dihydrogen Phosphate in Four Binary Solvents at Different Temperatures of 283.15–323.15 K, as well as Correlation, Solvent Effects, and the Inorganic Salt-Induced Liquid–Liquid Phase Separation Phenomenon","authors":"Wenhao Yan, Sheng Liu, Jiaqi Luo, Yingchen Wang, Qiutong Zhang, Yimin Jia, Mingting Yuan, Yuan Zou, Xinyue Zhai and Qiushuo Yu*, ","doi":"10.1021/acs.jced.5c00192","DOIUrl":"https://doi.org/10.1021/acs.jced.5c00192","url":null,"abstract":"<p >The mole-fraction solubility of ammonium dihydrogen phosphate (MAP) in four binary solvent systems: water + n-propanol, water + i-propanol, water + tert-butanol, and water + acetone, was determined by the gravimetric method at atmospheric pressure and temperatures ranging from 283.15 to 323.15 K. It was found that the solubility of MAP increased with increasing temperature and with the mole fraction of water in the binary solvent systems. In this study, the structural characteristics and intermolecular interactions of MAP molecules were analyzed by using the molecular electrostatic potential surface (MEPS) and Hirshfeld surface (HS). Correlation analysis of the experimental solubility data was carried out by the modified Apelblat equation, the van’t Hoff equation, the λh equation, and the Jouyban–Acree model. The relative deviation, mean relative deviation, and root-mean-square deviation were also calculated. The analysis results showed that the modified Apelblat equation was the best correlation model. At the same time, this study also provides a reasonable explanation for the phenomenon of inorganic salt-induced liquid–liquid phase separation in the experiment.</p>","PeriodicalId":42,"journal":{"name":"Journal of Chemical & Engineering Data","volume":"70 8","pages":"3412–3427"},"PeriodicalIF":2.1,"publicationDate":"2025-07-16","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"144826175","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"工程技术","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Nicolás Espitia-Galindo, Pedro A. Martinez-Montoya, Lubomir Hnedkovsky*, Edgar F. Vargas and Glenn Hefter,
{"title":"Densities and Apparent Molar Volumes of Aqueous Solutions of Metal Nitrates to Elevated Temperatures: 1. Zinc Nitrate, Including Some Ternary Mixtures with Nitric Acid","authors":"Nicolás Espitia-Galindo, Pedro A. Martinez-Montoya, Lubomir Hnedkovsky*, Edgar F. Vargas and Glenn Hefter, ","doi":"10.1021/acs.jced.5c00241","DOIUrl":"https://doi.org/10.1021/acs.jced.5c00241","url":null,"abstract":"<p >Densities of aqueous solutions of zinc nitrate, Zn(NO<sub>3</sub>)<sub>2</sub>, and some of its ternary mixtures with nitric acid have been determined by vibrating tube densimetry at temperatures 293.15 K ≤ <i>T</i>/K ≤ 473.15, molalities 0.02 ≲ <i>m</i>/mol kg<sup>–1</sup> ≲ 5, and pressures <i>p</i> = 0.102 or 2.00 MPa. Values of the apparent molar volumes (<i>V</i><sub>ϕ</sub>) of Zn(NO<sub>3</sub>)<sub>2</sub>(aq) derived from these data easily fitted within the estimated experimental uncertainties. At 298.15 K, the present results agreed well with literature values at <i>m</i> > 1 mol kg<sup>–1</sup>. However, at lower molalities, the literature results were found to be scattered, with <i>V</i><sub>ϕ</sub> sometimes increasing anomalously with decreasing <i>m</i>, probably due to hydrolysis of Zn<sup>2+</sup>(aq). No meaningful comparisons were possible at other temperatures, but plots of the standard molar volumes, <i>V</i>°(Zn(NO<sub>3</sub>)<sub>2</sub>(aq)), against temperature, closely paralleled those of related nitrate salts. Volumes of some ternary mixtures (Zn(NO<sub>3</sub>)<sub>2</sub> + HNO<sub>3</sub> + H<sub>2</sub>O) were well-described by Young’s rule at low to moderate ionic strengths. The present results greatly expand the available volumetric database for both binary and ternary aqueous solutions of this industrially important electrolyte.</p>","PeriodicalId":42,"journal":{"name":"Journal of Chemical & Engineering Data","volume":"70 8","pages":"3190–3199"},"PeriodicalIF":2.1,"publicationDate":"2025-07-14","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"144826224","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"工程技术","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
{"title":"Heat Capacities of Aqueous Solutions of HNO3, Mg(NO3)2, Ni(NO3)2, and Co(NO3)2, and Some of Their Mixtures, at 298.15 K and 0.1 MPa","authors":"Xiong Xiao, Lubomir Hnedkovsky* and Glenn Hefter, ","doi":"10.1021/acs.jced.5c00240","DOIUrl":"https://doi.org/10.1021/acs.jced.5c00240","url":null,"abstract":"<p >Heat capacities of binary aqueous solutions of HNO<sub>3</sub>, Mg(NO<sub>3</sub>)<sub>2</sub>, Ni(NO<sub>3</sub>)<sub>2</sub>, and Co(NO<sub>3</sub>)<sub>2</sub> have been measured up to high concentrations using a Picker-type flow calorimeter at 298.15 K and 0.1 MPa. Where comparisons were possible, the present results were mostly in good agreement with literature data. Greater differences in Ni(NO<sub>3</sub>)<sub>2</sub>(aq) and Co(NO<sub>3</sub>)<sub>2</sub>(aq) may be due to cation hydrolysis. Heat capacities were well fitted with an extended Redlich–Rosenfeld–Meyer-type equation for HNO<sub>3</sub>(aq), and Pitzer-type equations for the three salts. Ternary solutions HNO<sub>3</sub> + M(NO<sub>3</sub>)<sub>2</sub> (M = Mg, Ni, Co) were measured as functions of solution composition at constant ionic strengths of (6.0–12.0, 12.0, and 10.44) mol·kg<sup>–1</sup>, respectively. In addition, data were obtained at constant molality fractions for Mg(NO<sub>3</sub>)<sub>2</sub> + HNO<sub>3</sub> at <i>x</i>(Mg<sup>2+</sup>) = 0.3331, and for Ni(NO<sub>3</sub>)<sub>2</sub> + HNO<sub>3</sub> at <i>x</i>(Ni<sup>2+</sup>) = 0.2523. It was established that ternary solution heat capacities could be predicted from binary component properties alone, either using Young’s rule (based on molar quantities) or an empirical mixing rule based on massic (“specific”) heat capacities; neither requires information beyond the relevant binary solution quantities, i.e., no additional mixing parameters are needed.</p>","PeriodicalId":42,"journal":{"name":"Journal of Chemical & Engineering Data","volume":"70 8","pages":"3178–3189"},"PeriodicalIF":2.1,"publicationDate":"2025-07-14","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"144826226","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"工程技术","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
{"title":"Solid–Liquid Phase Equilibria and Solubility Modeling of the Quaternary System LiBr–KBr–Li2SO4–K2SO4–H2O at 288.2 K","authors":"Wen-Feng Luo, Shi-Hua Sang* and Han-Zhong Zhang, ","doi":"10.1021/acs.jced.5c00159","DOIUrl":"https://doi.org/10.1021/acs.jced.5c00159","url":null,"abstract":"<p >The solid–liquid phase equilibria of the quaternary system LiBr–KBr–Li<sub>2</sub>SO<sub>4</sub>–K<sub>2</sub>SO<sub>4</sub>–H<sub>2</sub>O at 288.2 K were investigated in detail by the isothermal dissolution equilibrium method. The dry salt phase diagram and the three-dimensional phase diagram of the quaternary system were plotted. The phase diagrams show three invariant points, seven univariate curves, and five solid phase crystallization regions corresponding to K<sub>2</sub>SO<sub>4</sub>, Li<sub>2</sub>SO<sub>4</sub>·H<sub>2</sub>O, Li<sub>2</sub>SO<sub>4</sub>·K<sub>2</sub>SO<sub>4</sub>, KBr, and LiBr·2H<sub>2</sub>O. Lithium bromide exhibited the highest solubility, which increased significantly with rising temperature and showed a strong salting-out effect on KBr, K<sub>2</sub>SO<sub>4</sub>, and Li<sub>2</sub>SO<sub>4</sub>. Solubility data at different temperatures were compared and discussed. Furthermore, the ion interaction parameters of the Pitzer model for this system were fitted using solubility data, and a solubility model for the quaternary system at 288.2 K was established. The solubility results from the model are in high agreement with the experimental results. This research provides solid–liquid phase equilibrium data for the development of underground brine rich in lithium, potassium, and bromine.</p>","PeriodicalId":42,"journal":{"name":"Journal of Chemical & Engineering Data","volume":"70 8","pages":"3402–3411"},"PeriodicalIF":2.1,"publicationDate":"2025-07-14","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"144826227","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"工程技术","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Yongwei Xu, Xiaosheng Zhao, Kejun Wang, Siming Xu, Yuanjun Che, Hongchen Liu* and Qian Wang*,
{"title":"Preparation and Properties of a High-Performance Deep Eutectic Solvent ChCl-AEEA for Carbon Dioxide Capture","authors":"Yongwei Xu, Xiaosheng Zhao, Kejun Wang, Siming Xu, Yuanjun Che, Hongchen Liu* and Qian Wang*, ","doi":"10.1021/acs.jced.5c00130","DOIUrl":"https://doi.org/10.1021/acs.jced.5c00130","url":null,"abstract":"<p >Deep eutectic solvents (DESs) have emerged as a new class of eco-friendly solvents for carbon dioxide (CO<sub>2</sub>) capture due to their excellent properties and good stability. In this work, a high-performance deep eutectic solvent ChCl-AEEA absorbent with choline chloride (ChCl) as a hydrogen bond acceptor (HBA) and aminoethyl ethanolamine (AEEA) as a hydrogen bond donor (HBD) was prepared. The formation process of the ChCl-AEEA was determined by Fourier transform infrared spectroscopy (FTIR) and differential scanning calorimeter (DSC); the effects of AEEA proportion in the DES β, water content ω<sub>H<sub>2</sub>O</sub>, temperature <i>T</i>, and pressure <i>p</i><sub>CO<sub>2</sub></sub> on the CO<sub>2</sub> absorption capacity of the DES were investigated. The results showed that the CO<sub>2</sub> absorption capacity α of the DES could be as high as 0.8528 mol of CO<sub>2</sub>/mol of DES (0.3373 g of CO<sub>2</sub>/g of DES) at 313.2 K and 0.1 MPa when ω<sub>H<sub>2</sub>O</sub> was 51.9 wt % and β was 0.8. The corresponding absorption heat was measured to be −48.34 kJ/mol, indicating a low energy consumption for desorption. The absorption capacity of the DES did not change after five absorption and desorption cycles. The absorption of CO<sub>2</sub> in the prepared DES was chemical absorption, which was confirmed by FTIR and the <sup>13</sup>C nuclear magnetic resonance (<sup>13</sup>C NMR) spectrum.</p>","PeriodicalId":42,"journal":{"name":"Journal of Chemical & Engineering Data","volume":"70 8","pages":"3049–3058"},"PeriodicalIF":2.1,"publicationDate":"2025-07-14","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"144826225","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"工程技术","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
{"title":"","authors":"Ankush Bakshi, Chandani Sharma and Meena Sharma*, ","doi":"","DOIUrl":"","url":null,"abstract":"","PeriodicalId":42,"journal":{"name":"Journal of Chemical & Engineering Data","volume":"70 7","pages":"XXX-XXX 12260–12268"},"PeriodicalIF":2.0,"publicationDate":"2025-07-10","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://pubs.acs.org/doi/pdf/10.1021/acs.jced.5c00083","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"144587291","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"工程技术","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"OA","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Antonio Marcilla, María Martínez-Rodríguez and María del Mar Olaya*,
{"title":"","authors":"Antonio Marcilla, María Martínez-Rodríguez and María del Mar Olaya*, ","doi":"","DOIUrl":"","url":null,"abstract":"","PeriodicalId":42,"journal":{"name":"Journal of Chemical & Engineering Data","volume":"70 7","pages":"XXX-XXX 12260–12268"},"PeriodicalIF":2.0,"publicationDate":"2025-07-10","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://pubs.acs.org/doi/pdf/10.1021/acs.jced.5c00107","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"144587293","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"工程技术","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"OA","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
{"title":"","authors":"Iwan Townson, and , Peter Englezos*, ","doi":"","DOIUrl":"","url":null,"abstract":"","PeriodicalId":42,"journal":{"name":"Journal of Chemical & Engineering Data","volume":"70 7","pages":"XXX-XXX 12260–12268"},"PeriodicalIF":2.0,"publicationDate":"2025-07-10","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://pubs.acs.org/doi/pdf/10.1021/acs.jced.5c00165","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"144587296","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"工程技术","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"OA","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Shariq Farhan Elahi, Saurav Prasad, M. Ali Haider, Madhulika Gupta* and Ejaz Ahmad*,
{"title":"","authors":"Shariq Farhan Elahi, Saurav Prasad, M. Ali Haider, Madhulika Gupta* and Ejaz Ahmad*, ","doi":"","DOIUrl":"","url":null,"abstract":"","PeriodicalId":42,"journal":{"name":"Journal of Chemical & Engineering Data","volume":"70 7","pages":"XXX-XXX 12260–12268"},"PeriodicalIF":2.0,"publicationDate":"2025-07-10","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://pubs.acs.org/doi/pdf/10.1021/acs.jced.5c00131","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"144587300","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"工程技术","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"OA","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}