• Title/Summary/Keyword: Chemical reaction optimization

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Study on the Industrial Process of Rubber Anti-oxidant RD

  • Liu, Yu;Gao, Qinyu;Liu, Lianxin;Shi, Guangxia
    • Journal of the Korean Chemical Society
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    • v.55 no.5
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    • pp.830-834
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    • 2011
  • This paper is on the industrial synthesis process of anti-oxidant RD ((2,2,4-trimethyl-1,2-dihydroquinoline polymer $(C_{12}H_{15}N)_n$. n=2-4)).The content of dimer, trimer and tetramer of RD as the inspection targets, using the orthogonal design method - take the ratios of keto-amine, the reaction time, the reaction temperatures and the ratios of catalyst acid-amine as inspect factors - to optimized the reaction condition. The results indicate that the best ratio of keto-amine is 2:1, the time of salification and condensation is 3 hours and 7.5 hours. The range of temperature of salification and condensation is $135^{\circ}C$ and $120-125^{\circ}C$, and that the best ratio of acid-amine is 0.2: 1 (the proportion is the concentration ratio for mole). Under the optimization conditions, the yield of RD was stabilized and content of RD more than 45%.

Development of Hexafluoropropylene Hydrogenation with Pd/C Particles Prepared with 1-Hexyl-3-methylimidazolium Tetrafluoroborate (1-Hexyl-3-methylimidazolium Tetrafluoroborate으로 제조된 팔라듐 탄소촉매를 이용한 Hexafluoropropylene 수소화 반응)

  • Jeong, Ji Baek;Yoo, Kye Sang
    • Applied Chemistry for Engineering
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    • v.24 no.4
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    • pp.412-415
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    • 2013
  • Palladium on carbon powder was prepared using 1-hexyl-3-methylimidazolium tetrafluoroborate, one of room temperature ionic liquids. The synthesized particles were tested as a hexafluoropropylene hydrogenation catalyst. Moreover, the hydrogenation was performed under various reaction conditions to develop an optimum reaction process. The catalyst prepared by more than 3 wt% of palladium and the unity mole ratio of ionic liquid to palladium precursor showed higher catalytic activity. For reaction conditions, the complete hexafluoropropylene (HFP) conversion was achieved at these conditions; the volume flow ratio of hydrogen to HFP was higher than 1.25 and $GHSV_{HFP}$ was lower than 50000 mL/g-h.

Probing of Electrochemical Reactions for Battery Applications by Atomic Force Microscopy

  • Kim, Yun-Seok
    • Proceedings of the Korean Vacuum Society Conference
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    • 2013.08a
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    • pp.98.2-98.2
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    • 2013
  • Electrochemical phenomena underpin a broad spectrum of energy, chemical, and information technologies such as resistive memories and secondary batteries. The optimization of functionalities in these devices requires understanding electrochemical mechanisms on the nanoscale. Even though the nanoscale electrochemical phenomena have been studied by electron microscopies, these methods are limited for analyzing dynamic electrochemical behavior and there is still lack of information on the nanoscale electrochemical mechanisms. The alternative way can be an atomic force microscopy (AFM) because AFM allows nanoscale measurements and, furthermore, electrochemical reaction can be controlled by an application of electric field through AFM tip. Here, I will summarize recent studies to probe nanoscale electrochemical reaction in battery applications by AFM. In particular, we have recently developed electromechanical based AFM techniques for exploring reversible and irreversible electrochemical phenomena on the nanoscale. The present work suggests new strategies to explore fundamental electrochemical mechanisms using the AFM approach and eventually will provide a powerful paradigm for probing spatially resolved electrochemical information for energy applications.

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Development of Electro-Chemical process for dyeing wasetewater treatment (전기산화반응을 이용한 염색폐수 색도제거 공정 기술개발)

  • Sin, Dong-Hun;Choe, Jang-Seung;Jo, Seok-Jin;Lee, Sang-Heon;Kim, Sun-Hyeon;Choe, Seong-Uk
    • Proceedings of the Korean Society of Dyers and Finishers Conference
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    • 2008.10a
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    • pp.117-118
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    • 2008
  • The main objectives of this study are develop an Electro-Chemical process for dyeing wastewater treatment. In this work, We are investigated to optimization of electro-chemical process condition such as pH, additives(NaCl), reaction time, current density. As a result, About 89% of color(influent 452.5 ptco. unit) was removed by Electro-Chemical process using type C $SnO_2$ electrode. This results are promising potential for dyeing wastewater treatment.

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Optimization of Catalytic Reaction for Synthesis of 2-Methyl-4-methoxydiphenylamine (2-Methyl-4-methoxydiphenylamine 합성을 위한 촉매반응의 최적화)

  • Cho, Jeong-Woo;Kim, Eun-Seok;Kim, Kiseok;Kim, Seong-Hoon
    • Applied Chemistry for Engineering
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    • v.10 no.2
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    • pp.293-298
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    • 1999
  • Reaction mechanism was elucidated and reaction condition were optimized for the catalytic reaction synthesizing 2-methyl-4-methoxy-diphenylamine (MMDPA) which is an intermediate of Fluoran heat-sensitive dyestuff. Reactants consisted of 2-methyl-4-methoxyaniline (MMA), 3-methyl-4-nitroanisole (MNA), and cyclohexanone, and 5 wt % Pd/C was used as a catalyst. Experiments were run in an open slurry reactor equipped with reflux condenser, and products were analyzed by means of GC/MS and NMR. MMDPA yield of 90 mole % could be obtained after reaction time of 8~10 hours under the optimal reaction conditions comprising the reaction mass composition of MMA : MNA : cyclohexanone = 1 : 2 : 150 based on MMA input of 0.01 gmoles in xylene solvent, reaction temperature of $160^{\circ}C$, and catalyst amount of 0.5 g. It was found that the rate-determining step of overall reaction was dehydrogenation of the intermediate product obtained from condensation of MMA and cyclohexanone. Overall reaction rate and MMDPA yield were enhanced owing to hydrogen transfer reaction by introducing MNA together with MMA in the reaction mass. Excess cyclohexanone in the reaction mass played an important role of promoting the condensation of MMA and cyclohexanone.

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Optimization and characterization of biodiesel produced from vegetable oil

  • Mustapha, Amina T.;Abdulkareem, Saka A.;Jimoh, Abdulfatai;Agbajelola, David O.;Okafor, Joseph O.
    • Advances in Energy Research
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    • v.1 no.2
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    • pp.147-163
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    • 2013
  • The world faces several issues of energy crisis and environmental deterioration due to over-dependence on single source of which is fossil fuel. Though, fuel is needed as ingredients for industrial development and growth of any country, however the fossil fuel which is a major source of energy for this purpose has always been terrifying thus the need for alternative and renewable energy sources. The search for alternative energy sources resulted into the acceptance of a biofuel as a reliable alternative energy source. This work presents the study of optimization of process of transesterification of vegetable oil to biodiesel using NaOH as catalyst. A $2^4$ factorial design method was employed to investigate the influence of ratio of oil to methanol, temperature, NaOH concentration, and transesterification time on the yield of biodiesel from vegetable oil. Low and high levels of the key factors considered were 4:1 and 6:1 mole ratio, 30 and $60^{\circ}C$ temperatures, 0.5 and 1.0 wt% catalyst concentration, and 30 and 60 min reaction time. Results obtained revealed that oil to methanol molar ratio of 6:1, tranesetrification temperature of $60^{\circ}C$, catalyst concentration of 1.0wt % and reaction time of 30 min are the best operating conditions for the optimum yield of biofuel from vegetable oil, with optimum yield of 95.8%. Results obtained on the characterizzation of the produced biodiesel indicate that the specific gravity, cloud point, flash point, sulphur content, viscosity, diesel index, centane number, acid value, free glycerine, total glycerine and total recovery are 0.8899, 4, 13, 0.0087%, 4.83, 25, 54.6. 0.228mgKOH/g, 0.018, 0.23% and 96% respectively. Results also indicate that the qualities of the biodiesel tested for are in conformity with the set standard. A model equation was developed based on the results obtained using a statistical tool. Analysis of variance (ANOVA) of data shows that mole ratio of ground nut oil to methanol and transesterification time have the most pronounced effect on the biodiesel yield with contributions of 55.06% and 9.22% respectively. It can be inferred from the results various conducted that vegetable oil locally produced from groundnut oil can be utilized as a feedstock for biodiesel production.

Optimization of O/W Emulsion with Natural Surfactant Extracted from Medicago sativa L. using CCD-RSM (CCD-RSM을 이용한 알팔파 추출물인 천연계면활성제가 포함된 O/W 유화액의 최적화)

  • Seheum Hong;Jiachen Hou;Seung Bum Lee
    • Applied Chemistry for Engineering
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    • v.34 no.2
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    • pp.137-143
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    • 2023
  • In this study, natural surfactants were extracted from Medicago sativa L. The O/W emulsification processes with the extracted natural surfactants were optimized using central composite design model-response surface methodology (CCD-RSM) and a 95% confidence interval was used to confirm the reasonableness of the optimization. Herein, independent parameters were the ratio of saponins to total surfactant (P), amount of surfactant (W), and emulsification speed (R), whereas the reaction parameters were the emulsion stability index (ESI), mean droplet size (MDS), and viscosity (V). Using the multiple reaction, the optimal conditions for the ratio of saponins to total surfactant, amount of surfactant, and emulsification speed for O/W emulsification were 49.5%, 9.1 wt%, and 6559.5 rpm, respectively. Under these optimal conditions, the expected values of ESI, MDS, and V as the reaction parameters were 89.9%, 1058.4 nm, and 1522.5 cP, respectively. The values of ESI, MDS, and V from these expected values were 88.7%, 1026.4 nm, and 1486.5 cP, respectively, and the average experimental error for validating the accuracy was about 2.3 (± 0.4)%. Therefore, it was possible to design an optimization process for evaluating the O/W emulsion process with Medicago sativa L. using CCD-RSM.

Study on the Process Condition for Producing Propylene Carbonate in Commercial (상업적으로 프로필렌카보네이트를 제조하기 위한 공정 조건 연구)

  • Jin, Sang Hyun;Lee, Hak Beum;Back, Jea Beom
    • Journal of Energy Engineering
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    • v.29 no.1
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    • pp.58-62
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    • 2020
  • Among the exhaust gas, Carbon dioxide which is a causative factor in greenhouse effect. We study for synthesis of propylene carbonate with carbon dioxide which is captured and utilized in commercially valuable. The Experiment was proceeded as pilot scale with using homogeneous organic catalyst which is able to produce propylene carbonate in commercial and reaction conditions. Optimization condition for concentration of catalyst and reaction temperature, pressure was studied. We confirm that this process is eco-friendly method and commercial application due to the mild condition and also catalyst has a competitive price, reusability.

Conversion of Red-macroalgae Eucheuma spinosum to Platform Chemicals Under Ferric Chloride-catalyzed Hydrothermal Reaction (Ferric chloride를 이용한 Eucheuma spinosum으로부터 플렛폼 케미컬의 생산)

  • Jeong, Gwi-Taek;Kim, Sung-Koo
    • Korean Chemical Engineering Research
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    • v.58 no.2
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    • pp.293-300
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    • 2020
  • Eucheuma spinosum, red macro-algae, contains carrageenan as the major polysaccharide and is commercially produced in Indonesia, Malaysia, Philippines, China and Tanzania. In this study, E. spinosum was converted to sugar and platform chemicals (5-HMF, levulinic acid, formic acid) via FeCl3-catalytic hydrothermal reaction. In addition, statistical methodology (3-level 3-factor Box-Behnken design) was applied to optimize and evaluate the effects of reaction factors (reaction temperature, catalyst concentration and reaction time). As a result of optimization, the concentration of 5-HMF was obtained to be 2.96 g/L at 160 ℃, 0.4 M FeCl3 and 10 min. Optimal conditions of levulinic and formic acids were determined at 200 ℃, 0.6 M FeCl3 and 30 min, and the concentrations were obtained to be 4.26 g/L and 3.77 g/L, respectively.

Pyrolysis Reaction for the Treatment of Hazardous Halogenated Hydrocarbon Waste (유해 할로겐화 탄화수소 폐기물 처리를 위한 열분해 반응)

  • 조완근
    • Journal of Environmental Science International
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    • v.6 no.4
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    • pp.399-407
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    • 1997
  • The pyrolysis reactions of atomic hydrogen with chloroform were studied In a 4 cm 1.6. tubular flow reactor with low flow velocity 1518 cm/sec and a 2.6 cm 1.4. tubular flow reactor with high flow velocity (1227 cm/sec). The hydrogen atom concentration was measured by chemiluminescence titration with nitrogen dioxide, and the chloroform concentrations were determined using a gas chromatography. The chloroform conversion efficiency depended on both the chloroform flow rate and linear flow velocity, but 416 not depend on the flow rate of hydrogen atom. A computer model was employed to estimate a rate constant for the initial reaction of atomic hydrogen with chloroform. The model consisted of a scheme for chloroform-hydrogen atom reaction, Runge-Kutta 4th-order method for Integration of first-order differential equations describing the time dependence of the concentrations of various chemical species, and Rosenbrock method for optimization to match model and experimental results. The scheme for chloroform-hydrogen atom reaction Included 22 elementary reactions. The rate constant estimated using the data obtained from the 2.6 cm 1.4. reactor was to be 8.1 $\times$ $10^{-14}$ $cm^3$/molecule-sec and 3.8 $\times$ $10^{-15}$ cms/molecule-sec, and the deviations of computer model from experimental results were 9% and 12% , for the each reaction time of 0.028 sec and 0.072 sec, respectively.

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