TY - JOUR
T1 - A Combined Experimental and Theoretical Investigation of Volumetric, Acoustical and Optical Properties and Interaction Parameters in the Ternary (3-Amino-1-Propanol + Dimethylacetamide + Cyclohexanone) and Its Sub-systems at Different Temperatures
AU - Vaali, Soheyl
AU - Iloukhani, Hossein
AU - Khanlarzadeh, Khatereh
AU - Hernández, Ariel
N1 - Publisher Copyright:
© The Author(s), under exclusive licence to Springer Science+Business Media, LLC, part of Springer Nature 2025.
PY - 2025/12
Y1 - 2025/12
N2 - The volumetric, optical, and acoustical properties of binary and ternary solutions of (3-amino-1-propanol + N,N-dimethylacetamide), (3-amino-1-propanol + cyclohexanone), (N,N-dimethylacetamide + cyclohexanone), and (3-amino-1-propanol + N,N-dimethylacetamide + cyclohexanone) were investigated in this study. Density (ρ), speed of sound (u), and refractive index (nD) were measured across the entire composition range at 298.15, 303.15, 308.15, 313.15, 318.15, and 323.15 K at ambient pressure (81.5 kPa). Excess molar volumeVmE, excess partial molar volume V¯iE, deviations in isentropic compressibilityΔks, or refractive index ΔnD, were also calculated. Binary mixtures of 3-amino-1-propanol + N,N-dimethylacetamide and N,N-dimethylacetamide + cyclohexanone showed positive VmE and Δks values, while 3-amino-1-propanol + cyclohexanone exhibited negative values. ΔnD values were negative for 3-amino-1-propanol + N,N-dimethylacetamide and positive for the other two binary mixtures.VmE,Δks, and ΔnD were correlated using the Redlich–Kister and Cibulka equations for binary and ternary mixtures, respectively. The Perturbed Chain Statistical Associating Fluid Theory (PC-SAFT) equation of state proved to be an effective tool for modeling the density of binary mixtures and ternary mixture. For modeling speed of sound as predictive approach in these mixtures, Schaaff’s Collision Factor Theory and Nomoto’s Relation were employed as theoretical models. Additionally, four mixing rules were successfully applied to predict the refractive index of the studied mixtures. These findings provide insights into intermolecular interactions, molecular size differences, and structural characteristics within the mixtures.
AB - The volumetric, optical, and acoustical properties of binary and ternary solutions of (3-amino-1-propanol + N,N-dimethylacetamide), (3-amino-1-propanol + cyclohexanone), (N,N-dimethylacetamide + cyclohexanone), and (3-amino-1-propanol + N,N-dimethylacetamide + cyclohexanone) were investigated in this study. Density (ρ), speed of sound (u), and refractive index (nD) were measured across the entire composition range at 298.15, 303.15, 308.15, 313.15, 318.15, and 323.15 K at ambient pressure (81.5 kPa). Excess molar volumeVmE, excess partial molar volume V¯iE, deviations in isentropic compressibilityΔks, or refractive index ΔnD, were also calculated. Binary mixtures of 3-amino-1-propanol + N,N-dimethylacetamide and N,N-dimethylacetamide + cyclohexanone showed positive VmE and Δks values, while 3-amino-1-propanol + cyclohexanone exhibited negative values. ΔnD values were negative for 3-amino-1-propanol + N,N-dimethylacetamide and positive for the other two binary mixtures.VmE,Δks, and ΔnD were correlated using the Redlich–Kister and Cibulka equations for binary and ternary mixtures, respectively. The Perturbed Chain Statistical Associating Fluid Theory (PC-SAFT) equation of state proved to be an effective tool for modeling the density of binary mixtures and ternary mixture. For modeling speed of sound as predictive approach in these mixtures, Schaaff’s Collision Factor Theory and Nomoto’s Relation were employed as theoretical models. Additionally, four mixing rules were successfully applied to predict the refractive index of the studied mixtures. These findings provide insights into intermolecular interactions, molecular size differences, and structural characteristics within the mixtures.
KW - Cibulka
KW - Excess molar volume
KW - Nomoto’s Relation
KW - PC-SAFT
KW - Redlich–Kister
KW - Schaaff’s Collision Factor Theory
UR - http://www.scopus.com/inward/record.url?scp=105018219184&partnerID=8YFLogxK
U2 - 10.1007/s10765-025-03657-8
DO - 10.1007/s10765-025-03657-8
M3 - Article
AN - SCOPUS:105018219184
SN - 0195-928X
VL - 46
JO - International Journal of Thermophysics
JF - International Journal of Thermophysics
IS - 12
M1 - 187
ER -