2021
DOI: 10.1021/acs.jced.0c00796
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Solubility Determination and Thermodynamic Modeling of Amitriptyline Hydrochloride in 13 Pure Solvents at Temperatures of 283.15–323.15 K

Abstract: In this work, the solubility of amitriptyline hydrochloride (AMT) in 13 monosolvents was experimentally measured in the temperatures ranging from 283.15 to 323.15 K under atmospheric pressure with the aid of laser dynamic solubility monitor devices. The solubility as a function of temperature in different monosolvents was regressed using two activity coefficient models (Wilson and nonrandom two liquid (NRTL)) and three semiempirical equations (modified Apelblat, three-parameter Van’t Hoff, and λh), Based on th… Show more

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Cited by 8 publications
(13 citation statements)
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“…The model parameters are listed in Tables –. For assessing the quality of the simulation results, relative average deviation (RAD) and root-mean-square deviation (RMSD), as defined in eqs and , were used. RAD = 1 N i = 1 N | x i exp x i cal x i exp | RMSD = i = 1 N false( x i exp x i cal false) 2 N where x i exp is the experimental solubility, x i cal is the simulated solubility, and N is the number of experimental points.…”
Section: Simulation Resultsmentioning
confidence: 99%
See 1 more Smart Citation
“…The model parameters are listed in Tables –. For assessing the quality of the simulation results, relative average deviation (RAD) and root-mean-square deviation (RMSD), as defined in eqs and , were used. RAD = 1 N i = 1 N | x i exp x i cal x i exp | RMSD = i = 1 N false( x i exp x i cal false) 2 N where x i exp is the experimental solubility, x i cal is the simulated solubility, and N is the number of experimental points.…”
Section: Simulation Resultsmentioning
confidence: 99%
“…The model parameters are listed in Tables –. For assessing the quality of the simulation results, relative average deviation (RAD) and root-mean-square deviation (RMSD), as defined in eqs and , were used. where x i exp is the experimental solubility, x i cal is the simulated solubility, and N is the number of experimental points.…”
Section: Simulation Resultsmentioning
confidence: 99%
“…The thermodynamic mixing properties of the real solution can be described by eqs and . normalΔ mix M = M normalE + normalΔ mix M id M = G , H 0.25em and 0.25em S where Δ mix M is the thermodynamic mixing property of the real solution; Δ mix M id is the thermodynamic mixing property of the ideal solution; and M E is the thermodynamic excess properties of the solution, which can be estimated using eqs −. , G normalE = R T ( x 1 ln γ 1 + x 2 ln γ 2 ) = prefix− R T [ x 1 ln false( x 1 + normalΛ 12 x 2 false) + x 2 ln false( x 2 + normalΛ 21 x 1 false) ] …”
Section: Resultsmentioning
confidence: 99%
“…The solubility of MSAM in the selected 13 pure solvents was measured in a jacketed crystallization flask of 100 mL, and the equilibrium of the dissolution was monitored in terms of a dynamic laser monitoring system comprising a laser generator, a photoelectric transformer, and a light intensity display. In order to verify the feasibility of the laser dynamic method, the solubility data of amitriptyline hydrochloride in n -propanol was first measured in this paper and then compared with those in ref . The comparison results are listed in Figure and Table , and the results show that this method is reliable.…”
Section: Methodsmentioning
confidence: 97%
“… a Standard uncertainties are u (T) = 0.05 K and u (p) = 0.5 kPa; relative standard uncertainty is u r ( x 1 ) = 0.05. x i and x i ref are the solubility data of amitriptyline hydrochloride in this work and in ref , respectively. …”
Section: Methodsmentioning
confidence: 99%