• Title/Summary/Keyword: binary mixtures

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Stoichiometric Solvation Effects. Solvolysis of Isopropylsulfonyl Chloride

  • Koo, In-Sun;Yang, Ki-Yull;Shin, Hyeon-Bae;An, Sun-Kyoung;Lee, Jong-Pal;Lee, Ik-Choon
    • Bulletin of the Korean Chemical Society
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    • v.25 no.5
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    • pp.699-703
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    • 2004
  • Solvolyses of isopropylsulfonyl chloride (IPSC) in water, D_2O,\;CH_3OD$, and in aqueous binary mixtures of acetone, ethanol and methanol are investigated at 25, 35 and 45$^{\circ}C$. The Grunwald-Winstein plot of first-order rate constants for the solvolytic reaction of IPSC with $Y_{Cl}$ (based on 2-adamantyl chloride) shows marked dispersions into three separate lines for three aqueous mixtures with a small slope (m < 0.30). The extended Grunwald-Winstein plots for the solvolysis of IPSC show better correlation. The kinetic solvent isotope effects determined in water and methanol are in consistent with the proposed mechanism of the general base catalyzed and/or $S_AN/S_N2$ reaction mechanism for IPSC solvolyses based on mass law and stoichiometric solvation effect studies.

Dielectric Study of Methyl Acrylate-Alcohol Mixtures Using Time Domain Reflectometry

  • Dharmalingam, K.;Ramachandran, K.;Sivagurunathan, P.;Prabhakar , B.;Khirade, P.W.;Mehrotra, S.C.
    • Bulletin of the Korean Chemical Society
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    • v.27 no.12
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    • pp.2040-2044
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    • 2006
  • Dielectric studies of methyl acrylate with 1-propanol, 1-butanol, 1-heptanol and 1-octanol binary mixtures have been carried out over the frequency range from 10 MHz to 10 GHz at temperatures of 283, 293, 303 and 313 K using Time Domain Reflectometry (TDR) for various concentrations. The Kirkwood correlation factor and excess inverse relaxation time were determined and discussed to yield information on the molecular structure and dynamics of the mixture. The values of the static dielectric constant, relaxation time and the Kirkwood correlation factor decrease with increased concentration of methyl acrylate in alcohol. The Bruggman plot shows a non-linearity of the curves for all the systems studied indicates the heterointeraction which may be due to hydrogen bonding of the OH group of alcohol with C=O of the methyl acrylate. The excess inverse relaxation time values are negative for all the systems at all the temperatures indicates that the solute-solvent interaction hinders the rotation of the dipoles of the system.

Stoichiometric Solvation Effects. Solvolysis of Trifluoromethanesulfonyl Chloride

  • Koo, In-Sun;Yang, Ki-Yull;Park, Jong-Kuen;Woo, Mi-Young;Cho, Jun-Mi;Lee, Jong-Pal;Lee, Ik-Choon
    • Bulletin of the Korean Chemical Society
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    • v.26 no.8
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    • pp.1241-1245
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    • 2005
  • Solvolyses of trifluoromethanesulfonyl chloride (TFMSC) in water and in aqueous binary mixtures of acetone, ethanol and methanol are investigated at 25, 35 and 45 ${^{\circ}C}$. The Grunwald-Winstein plot of first-order rate constants for the solvolytic reaction of TFMSC with YCl (based on 2-adamantyl chloride) shows marked dispersions into three separate curves for three aqueous mixtures. The extended Grunwald-Winstein plots for the solvolysis of TFMSC show better correlation. The large negative ${\Delta}S^{\neq}$ and relatively small positive ${\Delta}H^{\neq}$ reveals that the solvolytic reaction proceeds via a typical bimolecular reaction mechanism. The l and m values determined in various solvents are consistent with the proposed mechanism of the general base catalysis $S_AN/S_N2$reaction mechanism for TFMSC solvolyses based on mass law and stoichiometric solvation effect studies.

Prediction of Lower Explosion Limits of Binary Liquid Mixtures by Means of Solution Thermodynamics (용액열역학에 의한 2성분계 혼합물의 폭발하한계 예측)

  • Ha, Dong-Myeong;Lee, Sung-Jin
    • Journal of the Korean Institute of Gas
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    • v.13 no.5
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    • pp.20-25
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    • 2009
  • Low explosion limits of flammable liquid mixtures can be calculated with the appropriate use of the fundamental laws of Raoult, Dalton, Le Chatelier and activity coefficient models. In this paper, Raoult's law, van Laar equation and Wilson equation are shown to be applicable for the prediction of the lower explosion limits for ethylacetate+ethanol and ethanol+toluene systems. The calculated values based on Raoult's law were found to be better than those based on van Laar and Wilson equations.

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UV induced protonation of ammonia

  • Moon, Eui-Seong;Lee, Du-Hyeong;Kang, Heon
    • Proceedings of the Korean Vacuum Society Conference
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    • 2010.02a
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    • pp.394-394
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    • 2010
  • Ammonium ion (${NH_4}^+$) was suggested as the origin of interstellar $6.85\;{\mu}m$ band. Early study, in which organic molecule and water ice film mixtures were photolyzed so that organic acids could be produced, explained the generation of ${NH_4}^+$ from the reaction of photogenerated organic acid and ammonia ($NH_3$). However, the observed abundance of organic acids or their counter-anions are not so high in interstellar ice and not enough to protonate $NH_3$ into ${NH_4}^+$ in the observed level. Because of the shortage in photogenerated organic acids, the candidate of acid which protonates $NH_3$ should be modified. Here, we prepare $NH_3/H_2O$ binary mixtures and photolyze them with vacuum ultraviolet (VUV, peak at 10.6 and 10.0 eV). We find the ammonium ion (${NH_4}^+$) from photolyzed mixture by using low energy sputtering (LES) and reflection absorption IR spectroscopy (RAIRS). As a hydronium ($H_3O^+$) can be produced by UV irradiation and protonate bases, ${NH_4}^+$ may be formed from the reaction of photogenerated $H_3O^+$ and $NH_3$. We show the generation of ${NH_4}^+$ without any kind of organic molecules or acids, and it may explain the relatively high abundance of ${NH_4}^+$ compared to the counter-anions or organic acids in interstellar ice.

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Determination of Adulteration of Chicken Meat into Minced Beef Mixtures using Front Face Fluorescence Spectroscopy Coupled with Chemometric

  • Saleem, Asima;Sahar, Amna;Pasha, Imran;Shahid, Muhammad
    • Food Science of Animal Resources
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    • v.42 no.4
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    • pp.672-688
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    • 2022
  • The objective of this study was to explore the potential of front face fluorescence spectroscopy (FFFS) as rapid, non-destructive and inclusive technique along with multi-variate analysis for predicting meat adulteration. For this purpose (FFFS) was used to discriminate pure minced beef meat and adulterated minced beef meat containing (1%, 2%, 3%, 4%, 5%, 10%, 20%, 30%, 40%, 50%, 60%, 70%, 80%, 90%, and 100%) of chicken meat as an adulterant in uncooked beef meat samples. Fixed excitation (290 nm, 322 nm, and 340 nm) and fixed emission (410 nm) wavelengths were used for performing analysis. Fluorescence spectra were acquired from pure and adulterated meat samples to differentiate pure and binary mixtures of meat samples. Principle component analysis, partial least square regression and hierarchical cluster analysis were used as chemometric tools to find out the information from spectral data. These chemometric tools predict adulteration in minced beef meat up to 10% chicken meat but are not good in distinguishing adulteration level from 1% to 5%. The results of this research provide baseline for future work for generating spectral libraries using larger datasets for on-line detection of meat authenticity by using fluorescence spectroscopy.

Sorption Characteristics of Binary Mixture of Sugar and Sodium Chloride (저장상대습도(貯藏相對濕度)에 따른 당(糖)과 소금 이상혼합물(二相混合物)의 흡습특성(吸濕特性))

  • Oh, Hoon-Il;Kim, Woo-Jung;Park, Nae-Jung
    • Korean Journal of Food Science and Technology
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    • v.15 no.1
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    • pp.19-26
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    • 1983
  • A study was designed to investigate the sorption characteristics of binary mixtures of NaCl and sucrose or glucose stored at various relative humidities ranging from 46% to 92%. At low relative humidity below RH 65%, the sorption equilibrium was easily achieved, whereas at higher relative humidity values over 73%, all of the mixtures tended to cintinously absorb moisture with increase in storage time. A linear equation of log $({\frac{dw}{dt}})$ = a log(t) + log(b) was found to be valid between the sorption rate and storage time with respect to storage humidities. In sucrose-NaCl mixture, the slope showed a increasing tendency as the percentage of NaCl increased in the mixture, while that of glucose-NaCl mixture failed to show a definite trend. Plateaus were obtained when the amount of water absorbed was plotted on the X axis and the percent composition of mixture on the Y axis at different storage time. The shape of plateau was varied with respect to the kind of sugar-NaCl mixture, composition of the mixture and relative humidities. A linearity was found between log(1-Aw) and the amount of water absorbed over the Aw range 0.73-0.92 and the slope was affected by the kind and composition of sugar-NaCl mixtures.

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Solvation in Mixed Solvent (III). Solvatochromic Analysis for the Solvent Effect of Binary Mixed Solvent (혼합용매에서의 용매화 (제3보). 이성분 혼합용매 중에서 용매효과에 대한 분광용매화 분석)

  • Lee, Ik-Choon;La, Sang-Mu;Lee, Bon-Su;Sohn, Se-Chul
    • Journal of the Korean Chemical Society
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    • v.28 no.4
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    • pp.210-216
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    • 1984
  • Solvatochromic comparison methods were applied to determine Taft's solvent parameters, ${\pi}^{\ast}$(solvent polarity-polarizability), ${\alpha}$(solvent hydrogen bond donor acidity) and ${\beta}$ (solvent hydrogen bond acceptor basicity) for MeOH-MeCN solvent mixtures. Swain's solvent parameters A(anion solvation scale) and B(cation solvation scale) were also determined by least square fitting of kinetic data in the same binary solvent mixtures. It was found that: (i)${\beta}$ depends on the basicity of the solvent and increases with the MeOH content owing to the increase in polymeric structure of methanol; (ii) ${\pi}^{\ast}$depends on the dipole moment of the solvent and increases with the MeCN content of the solvent; (iii) ${\alpha}$ increases rapidly with the MeOH content as the hydrogen bond donor acidity of the solvent mixtures increases. Taft's reaction constants a and s and Swain's reaction constants a and b were determined for the reactions reported from our laboratory previously using solvent parameters determined in this work. No meaningful inter-relationship was found between the two set of reaction parameters, but a good linear correlation was found between the ratios a/s and a/b. Solvent effect on the reaction mechanism, substituent effect and leaving group ability were examined in the light of these reaction constants ratios.

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Correlation of the Rates of Solvolysis of 1-Piperidincarbonyl Chloride Using the Extended Grunwald-Winstein Equation

  • Choi, Ho-June;Ali, Dildar;Lee, Jong-Pal;Yang, Ki-Yull;Park, Jong-Keun;Koo, In-Sun
    • Bulletin of the Korean Chemical Society
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    • v.32 no.11
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    • pp.3941-3946
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    • 2011
  • The specific rates of sovolysis of 1-piperidincarbonyl chloride (1) have been determined in 26 pure and binary solvents at $25.0^{\circ}C$. Comparison of the specific rates of solvolyses of 1 with those for p-methoxybenzoyl chloride and those for 4-morpholinecarbonyl chloride in terms of linear free energy relationships (LFER) are helpful in mechanistic considerations, as is also treatment in terms of the extended Grunwald-Winstein equation. It is proposed that the solvolyses of 1 in binary aqueous solvent mixtures proceed through an ionization [I] pathway rather than through an $S_N1/S_N2$ and/or ionization/(ionization-elimination) = [I/(I-E)] pathway.

Mechanical properties of SFRHSC with metakaolin and ground pumice: Experimental and predictive study

  • Saridemir, Mustafa;Severcan, Metin Hakan;Celikten, Serhat
    • Steel and Composite Structures
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    • v.23 no.5
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    • pp.543-555
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    • 2017
  • The mechanical properties of steel fiber reinforced high strength concrete (SFRHSC) made with binary and ternary blends of metakaolin (MK) and ground pumice (GP) are investigated in this study. The investigated properties are ultrasonic pulse velocity ($U_{pv}$), compressive strength ($f_c$), flexural strength ($f_f$) and splitting tensile strength ($f_{st}$) of SFRHSC. A total of 16 steel fiber reinforced concrete mixtures were produced by a total binder content of $500kg/m^3$ for determining the effects of MK and GP on the mechanical properties. The design $f_c$ was acquired from 70 to 100 MPa by using a low water-binder ratio of 0.2. The test results exhibit that high strength concrete can be obtained by replacing the cement with MK and GP. Besides, correlations between these results are executed for comprehending the relationship between mechanical properties of SFRHSC and the strong correlations are observed between these properties. Moreover, two models in the gene expression programming (GEP) for predicting the $f_c$ of SFRHSC made with binary and ternary blends of MK and GP have been developed. The results obtained from these models are compared with the experimental results. These comparisons proved that the results of equations obtained from these models seem to agree with the experimental results.