• 한국식품영양학회지
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• 제8권3호
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• pp.172-183
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• 1995

The nucleophilic substitution reactions of p-substituted benzyl bromide with l-substituted N,N-dimethylanilines in methanol and acetonitrile binary solvent mixture which is known to an isodielectric solvent system kinetically and the results are as follows. The positive charge is developed on the reaction center of the substrate and it means that the bond cleavage is preceded more than bond formation in the transition state on the analogy of Hammett px values. The bond form3tlon is not progressed in the case of electron donating substituent of substrate. However, the bond formation is much developed in the case of electron withdrawing substituent of substrate on the analogy of Hammett py values. The nucleophilic attacking ability is shown a highest at 80% (V/V) methanol content and the bond formation is well progressed at the same methanol composition on the result of a cross interaction coefficient, pxy. The result of transition state structure that is applicated to the potential energy surface model is in accord with the result that Is applicated to the reaction susceptibilities. The reaction Is subject to the polarity-polarizability term more than the hydrogen bond donor acidity term by application to the solvatochromic parameter eouation.

• 공업화학
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• 제5권6호
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• pp.967-974
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• 1994

DGEBA(Diglycidyl ether of bisphenol A)/MDA(4, 4' -methylene dianiline)/MN(Malononitrile)/HQ(Hydroquinone)계의 경화 반응속도론을 differential scanning calorimetry(DSC)의 승온적 방법(dynamic runs)에 의해 Barrrett method와 Integral method로 연구하였다. 활성화 에너지, pre-exponential factor와 같은 kinetic parameter들이 구하여 졌으며 반응 차수는 본계가 n차 반응 속도식에 적용된다는 가정하에 추정되었다. MN(Malononitrile)은 본 반응의 사슬 연장제로, HQ(Hydroquinone)은 반응 가속제 또는 촉매로 도입되었다.

• Carbon letters
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• 제12권4호
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• pp.229-235
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• 2011

Isotactic polyacrylonitrile (PAN) with triad isotacticity of 0.53, which was determined by $^{13}C$ NMR, using dialkylmagnesium as an initiator, was successfully synthesized. Isothermal treatment of iso-PAN was conducted in air at 200, 220, 250 and $280^{\circ}C$. Structural evolutions and chemical changes were studied with Fourier transformation infrared and wide-angle X-ray diffraction during stabilization. A new parameter $CNF={I_{2240cm}}^{-1}/ ({I_{1595cm}}^{-1}+f^*{I_{1595cm}}^{-1})$ was defined to evaluate residual nitrile groups. Crystallinity and crystal size were calculated with X-ray diffraction dates. The results indicated that the nitrile groups had partly converted into a ladder structure as stabilization proceeded. The rate of reaction increased with treatment temperature; crystallinity and crystal size decreased proportionally to pyrolysis temperature. The iso-conversional method coupled with the Kissinger and Flynn-Wall-Ozawa methods were used to determine kinetic parameters via differential scanning calorimetry analysis with different heating rates. The active energy of the reaction was 171.1 and 169.1 kJ/mol, calculated with the two methods respectively and implied the sensitivity of the reaction with temperature.

• Korean Chemical Engineering Research
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• 제47권4호
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• pp.410-417
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• 2009

중간세공크기(mesopore)의 MCM41에 Imidazole을 담지시킨 CP-MS41 고체 입자의 촉매를 사용하여 GMA 용액에 $CO_2$를 흡수시켜 $CO_2$의 흡수기구로부터 GMA와 $CO_2$의 반응속도론을 고찰하였다. 대기압에서 회분식 흡수조를 사용하여 임펠러의 교반속도, 50 rpm, 촉매, 2 g, 반응온도, 60, 70, $80^{\circ}C$, GMA의 농도, $0.1{\sim}3.0kmol/m^3$, 용제, DMA, NMP, DMSO에서 측정한 $CO_2$의 흡수속도와 경막설에 의한 물질수지식을 사용하여 반응속도상수를 구하였다.

• 한국수자원학회논문집
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• 제33권1호
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• pp.73-85
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• 2000

농촌 소하천의 수리학적 및 수질특성을 반영한 모형을 개발하였다. 모형구조 설계시 제어체적 기법을 활용하여 하천 형상, 수질 및 유량의 변화가 심한 농촌 유역의 소하천에 대한 수질의 모의하였다. 개발한 모형에 난수발생기법을 도입하여 최적 반응계수와 모형구조를 추정하였다. 또한 모형 보정기준의 일반화를 위해 동의지표와 효율계수를 도입하여 매개변수추정의 신뢰성 향상을 도모했다. 모형의 적용성을 검증하기 위해 경남 김해시 한림면 용덕천에서 수질을 채취하여 분석하였다. 관측된 자료와 개발된 모형의 비교연구를 통해 대상유역의 소하천에서 일어나는 수질 반응계수들과 그 변동성을 추정하였다.

• 공업화학
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• 제21권5호
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• pp.586-589
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• 2010

본 연구에서는 1,3-dicarbonyl 화합물과 올레핀 화합물의 산화첨가반응에서 $Ag_2CO_3$/celite (SC)를 촉매로 하여 1,3-cycleohexandion (1,3-CHD)과 ethyl vinyl ether (EVE)를 acetonitrile (AN), dimethyl sulfoxide (DMSO), benzene (BZ), heptane (HT)을 각각 용매로 하여 반응을 진행시켜 보았다. 그 결과 수득률이 78, 40, 15, 10%로 나타났다. 따라서 이러한 용매의 효과에 따른 수득률의 변화를 알아보기 위하여 하이퍼캠의 반경험적 방법으로 PM3와 ZINDO/1 파라미터를 이용하여 이론적 고찰을 해 보았다.

• 반도체디스플레이기술학회지
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• 제19권1호
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• pp.29-35
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• 2020

The cure characteristics of three kinds of naphthalene type epoxy resins(NET-OH, NET-MA, NET-Epoxy) with a 2-methyl imidazole(2MI) catalyst were investigated for preparing sheet epoxy molding compound(SEMC) for wafer level package(WLP) applications, comparing with diglycidyl ether of bisphenol-A(DGEBA) and 1,6-naphthalenediol diglycidyl ether(NE-16) epoxy resin. The cure kinetics of these systems were analyzed by differential scanning calorimetry with an isothermal approach, and the kinetic parameters of all systems were reported in generalized kinetic equations with diffusion effects. The NET-OH epoxy resin represented an n-th order cure mechanism as like NE-16 and DGEBA epoxy resins, however, the NET-MA and NET-Epoxy resins showed an autocatalytic cure mechanism. The NET-OH and NET-Epoxy resins showed higher cure conversion rates than DGEBA and NE-16 epoxy resins, however, the lowest cure conversion rates can be seen in the NET-MA epoxy resin. Although the NETEpoxy and NET-MA epoxy resins represented higher cure reaction conversions comparing with DGEBA and NE-16 resins, the NET-OH showed the lowest cure reaction conversions. It can be figured out by kinetic parameter analysis that the lowest cure conversion rates of the NET-MA epoxy resin are caused by lower collision frequency factor, and the lowest cure reaction conversions of the NET-OH are due to the earlier network structures formation according to lowest critical cure conversion.

• 상하수도학회지
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• 제11권4호
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• pp.126-132
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• 1997

Trihalomethanes (THMs) are formed during the chlorination of waters containing precusors compounds, most commonly humic substances, changes in pH, TOC, temperature, precusor source and concentration chlorine dosage, bromide level and reaction time directly influence trihalomethane formation potential (THMFP) and kinetics. A standard THMFP experiment was conducted for each water under the following conditions ; $20^{\circ}C$, pH 7.4, reaction time of 48hr, TOC 5.7mgC/L. A series of kinetic experiments was conducted for each water to provide THM formation under varying conditions of reaction time, pH, temperature and TOC, chlorine dosage. The resultant mutiple parameter powre function predicts a THM which allows direct calculation of THM, is $[THM]=0.00039(pH-2.81)[TOC][Cl_2]^{0.321}\;t^{0.266}\;T^{0.286}$ Characteristics of raw water in advanced drinking water treatment pilot plant were, TOC levels ran from 4.42~6.84mgC/L, pH 7.2~7.8, temperature $7.0{\sim}18.4^{\circ}C$, UV-254 absorbance $0.057{\sim}0.85cm^{-1}$, THM levels ranged from 0.031~0.049mgC/L.

• Korean Chemical Engineering Research
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• 제59권1호
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• pp.138-151
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• 2021

The effect of a reactant ratio on the growth of a buoyancy-driven instability in an irreversible A+B→C reaction system is analyzed theoretically and numerically. Taking a non-stoichiometric reactant ratio into account, new linear stability equations are derived without the quasi-steady state assumption (QSSA) and solved analytically. It is found that the main parameters to explain the present system are the Damköhler number, the dimensionless density difference of chemical species and the ratio of reactants. The present initial grow rate analysis without QSSA shows that the system is initially unconditionally stable regardless of the parameter values; however, the previous initial growth rate analysis based on the QSSA predicted the system is unstable if the system is physically unstable. For time evolving cases, the present growth rates obtained from the spectral analysis and pseudo-spectral method support each other, but quite differently from that obtained under the conventional QSSA. Adopting the result of the linear stability analysis as an initial condition, fully nonlinear direct numerical simulations are conducted. Both the linear analysis and the nonlinear simulation show that the reactant ratio plays an important role in the onset and the growth of the instability motion.

• 한국막학회:학술대회논문집
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• 한국막학회 1996년도 추계 총회 및 학술발표회
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• pp.92-93
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• 1996

PVA membrane was widely used in the dehydration pervaporation process. PVA membrane showed remakable selectivity towed water and an excellent film-forming polymer, with a good resistance to orgamic solvents but it has poor stability in aqueous mixtures. Generally the PVA is manufactured by the hydrolysis reaction from poly vinyl acetate(PVAc) and so the degree of PVA hydrolysis is a major parameter for properties of PVA membrane such as the crystallinity and polarity.