Komal M. Jamkhande, Niraj T. Khaty, Chandrashekhar P. Pandhurnekar and Vijay M. Tangde*,
{"title":"盐酸度洛西汀和肌醇二元和三元混合物的热力学研究:体积、声学和粘度方法","authors":"Komal M. Jamkhande, Niraj T. Khaty, Chandrashekhar P. Pandhurnekar and Vijay M. Tangde*, ","doi":"10.1021/acs.jced.4c0061010.1021/acs.jced.4c00610","DOIUrl":null,"url":null,"abstract":"<p >The experimental data of densities (ρ), speed of sound (<i>u</i>) and viscosities (η) of <i>myo</i>-inositol (MI) in aqueous, duloxetine hydrochloride (DHCl) in aqueous and aqueous MI solution of different molal concentrations at seven temperatures in the range of (288.15–318.15) K has been reported. The thermophysical parameters like apparent molar volume (<i>V</i><sub>ϕ</sub>) of solute, limiting apparent molar volume (<i>V</i><sub>ϕ</sub><sup>0</sup>), partial molar volume of transfer (Δ<sub>tr</sub><i>V</i><sub>ϕ</sub><sup>0</sup>), thermal expansion coefficient (α*), limiting apparent molar expansibilities (<i>E</i><sub>ϕ</sub><sup>0</sup>), isentropic compressibility (κ<sub>S</sub>) of solution, apparent molar isentropic compression (<i>K</i><sub>ϕ</sub>) of solute, limiting apparent molar isentropic compression of solute (<i>K</i><sub>s,ϕ</sub><sup>0</sup>), partial molar compression of transfer (Δ<sub>tr</sub><i>K</i><sub>s,ϕ</sub><sup>0</sup>), and hydration number (<i>n</i><sub>H</sub>) were derived. The viscosity data have been used to determine the Falkenhagen coefficient <i>A</i> and Jones–Dole coefficient <i>B</i> on the basis of the Jones–Dole equation. By using the Nightingale, Benck, and Eyring equation, the free energy (Δ<i>E</i><sub>2</sub><sup>0≠</sup>), enthalpy (Δ<i>H</i><sub>2</sub><sup>0≠</sup>), and entropy of activation (Δ<i>S</i><sub>2</sub><sup>0≠</sup>) were calculated. The solvation behavior of DHCl and MI in aqueous systems has been presented. Results are discussed in terms of solute–solute, solute–solvent, hydrophobic hydration, and H-bonding interactions in the studied systems. It is observed that DHCl behaves as a structure maker in both binary and ternary systems.</p>","PeriodicalId":42,"journal":{"name":"Journal of Chemical & Engineering Data","volume":"70 2","pages":"890–907 890–907"},"PeriodicalIF":2.1000,"publicationDate":"2025-01-07","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"0","resultStr":"{\"title\":\"Thermodynamic Studies of Binary and Ternary Mixtures of Duloxetine Hydrochloride and myo-Inositol: A Volumetric, Acoustic, and Viscometric Approach\",\"authors\":\"Komal M. Jamkhande, Niraj T. Khaty, Chandrashekhar P. Pandhurnekar and Vijay M. Tangde*, \",\"doi\":\"10.1021/acs.jced.4c0061010.1021/acs.jced.4c00610\",\"DOIUrl\":null,\"url\":null,\"abstract\":\"<p >The experimental data of densities (ρ), speed of sound (<i>u</i>) and viscosities (η) of <i>myo</i>-inositol (MI) in aqueous, duloxetine hydrochloride (DHCl) in aqueous and aqueous MI solution of different molal concentrations at seven temperatures in the range of (288.15–318.15) K has been reported. The thermophysical parameters like apparent molar volume (<i>V</i><sub>ϕ</sub>) of solute, limiting apparent molar volume (<i>V</i><sub>ϕ</sub><sup>0</sup>), partial molar volume of transfer (Δ<sub>tr</sub><i>V</i><sub>ϕ</sub><sup>0</sup>), thermal expansion coefficient (α*), limiting apparent molar expansibilities (<i>E</i><sub>ϕ</sub><sup>0</sup>), isentropic compressibility (κ<sub>S</sub>) of solution, apparent molar isentropic compression (<i>K</i><sub>ϕ</sub>) of solute, limiting apparent molar isentropic compression of solute (<i>K</i><sub>s,ϕ</sub><sup>0</sup>), partial molar compression of transfer (Δ<sub>tr</sub><i>K</i><sub>s,ϕ</sub><sup>0</sup>), and hydration number (<i>n</i><sub>H</sub>) were derived. The viscosity data have been used to determine the Falkenhagen coefficient <i>A</i> and Jones–Dole coefficient <i>B</i> on the basis of the Jones–Dole equation. By using the Nightingale, Benck, and Eyring equation, the free energy (Δ<i>E</i><sub>2</sub><sup>0≠</sup>), enthalpy (Δ<i>H</i><sub>2</sub><sup>0≠</sup>), and entropy of activation (Δ<i>S</i><sub>2</sub><sup>0≠</sup>) were calculated. The solvation behavior of DHCl and MI in aqueous systems has been presented. Results are discussed in terms of solute–solute, solute–solvent, hydrophobic hydration, and H-bonding interactions in the studied systems. It is observed that DHCl behaves as a structure maker in both binary and ternary systems.</p>\",\"PeriodicalId\":42,\"journal\":{\"name\":\"Journal of Chemical & Engineering Data\",\"volume\":\"70 2\",\"pages\":\"890–907 890–907\"},\"PeriodicalIF\":2.1000,\"publicationDate\":\"2025-01-07\",\"publicationTypes\":\"Journal Article\",\"fieldsOfStudy\":null,\"isOpenAccess\":false,\"openAccessPdf\":\"\",\"citationCount\":\"0\",\"resultStr\":null,\"platform\":\"Semanticscholar\",\"paperid\":null,\"PeriodicalName\":\"Journal of Chemical & Engineering Data\",\"FirstCategoryId\":\"1\",\"ListUrlMain\":\"https://pubs.acs.org/doi/10.1021/acs.jced.4c00610\",\"RegionNum\":3,\"RegionCategory\":\"工程技术\",\"ArticlePicture\":[],\"TitleCN\":null,\"AbstractTextCN\":null,\"PMCID\":null,\"EPubDate\":\"\",\"PubModel\":\"\",\"JCR\":\"Q3\",\"JCRName\":\"CHEMISTRY, MULTIDISCIPLINARY\",\"Score\":null,\"Total\":0}","platform":"Semanticscholar","paperid":null,"PeriodicalName":"Journal of Chemical & Engineering Data","FirstCategoryId":"1","ListUrlMain":"https://pubs.acs.org/doi/10.1021/acs.jced.4c00610","RegionNum":3,"RegionCategory":"工程技术","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"Q3","JCRName":"CHEMISTRY, MULTIDISCIPLINARY","Score":null,"Total":0}
Thermodynamic Studies of Binary and Ternary Mixtures of Duloxetine Hydrochloride and myo-Inositol: A Volumetric, Acoustic, and Viscometric Approach
The experimental data of densities (ρ), speed of sound (u) and viscosities (η) of myo-inositol (MI) in aqueous, duloxetine hydrochloride (DHCl) in aqueous and aqueous MI solution of different molal concentrations at seven temperatures in the range of (288.15–318.15) K has been reported. The thermophysical parameters like apparent molar volume (Vϕ) of solute, limiting apparent molar volume (Vϕ0), partial molar volume of transfer (ΔtrVϕ0), thermal expansion coefficient (α*), limiting apparent molar expansibilities (Eϕ0), isentropic compressibility (κS) of solution, apparent molar isentropic compression (Kϕ) of solute, limiting apparent molar isentropic compression of solute (Ks,ϕ0), partial molar compression of transfer (ΔtrKs,ϕ0), and hydration number (nH) were derived. The viscosity data have been used to determine the Falkenhagen coefficient A and Jones–Dole coefficient B on the basis of the Jones–Dole equation. By using the Nightingale, Benck, and Eyring equation, the free energy (ΔE20≠), enthalpy (ΔH20≠), and entropy of activation (ΔS20≠) were calculated. The solvation behavior of DHCl and MI in aqueous systems has been presented. Results are discussed in terms of solute–solute, solute–solvent, hydrophobic hydration, and H-bonding interactions in the studied systems. It is observed that DHCl behaves as a structure maker in both binary and ternary systems.
期刊介绍:
The Journal of Chemical & Engineering Data is a monthly journal devoted to the publication of data obtained from both experiment and computation, which are viewed as complementary. It is the only American Chemical Society journal primarily concerned with articles containing data on the phase behavior and the physical, thermodynamic, and transport properties of well-defined materials, including complex mixtures of known compositions. While environmental and biological samples are of interest, their compositions must be known and reproducible. As a result, adsorption on natural product materials does not generally fit within the scope of Journal of Chemical & Engineering Data.