Apparent Dipole Moments of 1-Alkanols in Cyclohexane and <Emphasis Type="Italic">n</Emphasis>-Heptane,and Excess Molar Volumes of (1-Alkanol + Cyclohexane or <Emphasis Type="Italic">n</Emphasis>-Heptane) at 298.15 K |
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Authors: | M?EL-Hefnawy K?Sameshima T?Matsushita Email author" target="_blank">R?TanakaEmail author |
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Institution: | (1) Department of Chemistry, Graduate School of Science, Osaka City University, Sugimoto, Sumiyoshi-ku, 3-3-138, Osaka 558-8585, Japan |
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Abstract: | Excess molar volumes and relative permittivities at a frequency of 30 kHz were determined precisely for the binary mixtures of 1-alkanols, CnH2n+1OH for n = 1 to 10, with cyclohexane or n-heptane to the mole fraction of 1-alkanol, x, to 0.1 at a temperature of 298.15 K. Apparent dipole moments, , of the 1-alkanols were calculated by using the Frohlich equation, and the limiting values, 0, were determined by extrapolating to infinite dilution. The solvent effect on 0 was very small. The value of 0 was largest in methanol and decreased with increasing n. It was found that the alkanols were isolated up to x 0.003. The threshold of molecular interaction beyond this critical mole fraction was ascertained by means of FT-IR spectra. The dipole moments of the 1-alkanols for n = 1–4 were evaluated by ab initio calculations. The average values of 0 for the rotational configurations calculated by assuming the Boltzmann distribution agreed excellently with the observed ones. The excess partial molar volumes of 1-alkanols determined at the infinite dilution depended on n as well as the solvent. These results are discussed from the viewpoint of the interactions between the solute and solvent molecules. |
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Keywords: | Dipole moment permittivity excess volume 1-alkanol ab initio calculation |
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