• 공업화학
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• 제30권5호
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• pp.615-619
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• 2019

통계학적 실험계획법을 이용하여 다공성 구조체인 MOF-235 합성 공정 최적화를 수행하였다. 합성에 사용되는 주성분인 terephthalic acid (TPA), Iron (III) chloride hexahydrate, N,N-dimethylformamide (DMF) 및 ethanol의 농도가 MOF-235의 결정구조를 형성하는데 중요한 요소가 되었다. 다양한 농도의 4가지 성분을 이용하여 MOF-235를 합성한 후 XRD를 이용하여 결정도를 측정하였다. 16가지 실험조건을 통해 합성한 MOF-235의 결정도 결과를 통계학적 해석을 통해 주성분의 조성이 입자의 합성에 미치는 영향을 분석하였다. F 검정법을 이용한 분산분석에서 에탄올의 농도가 입자의 결정도에 가장 큰 영향을 미치고 TPA가 가장 영향력이 작은 것으로 분석되었다. 결정도를 예측할 수 있는 회귀모델을 도출하였고 2가지 합성변수에 대한 예측결과를 등고선도를 이용하여 제시하였다. 마지막으로 혼합물법을 이용하여 3가지 합성인자가 미치는 결정도를 예측하여 제시하였다.

• 공업화학
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• 제33권4호
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• pp.402-407
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• 2022

실험계획법을 이용하여 MOF-5 합성공정의 최적화에 대한 연구를 수행하였다. 먼저 전구체의 농도를 최적화 하기 위하여 혼합물 설계법을 이용하였다. 합성에 사용되는 세 가지 전구체인 terephthalic acid, zinc acetate dihydrate, N,N-dimethylformamide의 농도비를 extreme vertices design methods로 최적화 하였다. MOF-5 합성을 위한 최적의 농도는 1 mol : 2.7 mol : 40 mol로 예측되었다. 이후, 온도, 시간 및 교반 속도와 같은 합성 반응 조건이 합성에 미치는 영향을 분석하기 위해 다단계 요인 설계법을 사용하였다. 수행된 통계 분석에 따라 교반 속도는 후속 연구에서 제외되었다. 합성시간과 온도를 고려한 합성 공정 최적화는 중앙 조성 설계법을 이용하였다. 13번의 합성 실험을 통해 도출된 2차 모델 방정식을 이용하여 결과를 추정하였다. 설계에 사용된 모델에 의하면 119 ℃ 및 10.4 h 조건에서 합성된 MOF-5가 최대의 결정화도를 가지는 것으로 예측되었다.

• Toxicological Research
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• 제27권4호
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• pp.191-203
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• 2011

There has been growing concern about the toxicity of phthalate esters. Phthalate esters are being used widely for the production of perfume, nail varnish, hairsprays and other personal/cosmetic uses. Recently, exposure to phthalates has been assessed by analyzing urine for their metabolites. The parent phthalate is rapidly metabolized to its monoester (the active metabolite) and also glucuronidated, then excreted. The objective of this study is to evaluate the toxicity of phthalic acid (PA), which is the final common metabolic form of phthalic acid esters (PAEs). The individual PA isomers are extensively employed in the synthesis of synthetic agents, for example isophthalic acid (IPA), and terephthalic acid (TPA), which have very broad applications in the preparation of phthalate ester plasticizers and components of polyester fiber, film and fabricated items. There is a broad potential for exposure by industrial workers during the manufacturing process and by the general public (via vehicle exhausts, consumer products, etc). This review suggests that PA shows in vitro and in vivo toxicity (mutagenicity, developmental toxicity, reproductive toxicity, etc.). In addition, PA seems to be a useful biomarker for multiple exposure to PAEs in humans.

• 약학회지
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• 제38권3호
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• pp.230-237
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• 1994

The structure-activity relationships of (E)-chalcone-4-carboxylic acids, flavone-4'-carboxylic acids, two types of aromatic amides, terephthalic monoanilides, and (arylcarboxamido)benzoic acids, which were made by Shudo group, are discussed by conformation analysis(AM1) of retinoic acid and those compounds. Conformer of each compound is superimposed on the conformationally restricted compound, 4-(6,7,8,9-tetrahydro-6,6,9,9-tetramethyl-4H-4-oxonaphto[ 2,3-b]pyran-2-yl) benzoic acid(Fv80), possessing the strongest differentiation-inducing activity on human promyelocytic leukemia cells HL-60. The results indicated that the lengths between the carboxylic carbon and the two 6, 9 carbons binding to dimethyl, 1.20 nm and 1.09 nm, as well as the planarity of molecule are very important factors for the activity, especially 1.20 nm. In the case of the recently synthesized azulenic retinoic acids by Sato, et al. in 1993, the distance probably is also important, resulted from superimposing them on a Ch55 conformer and Fv80. The distance 1.0 nm is also important in Ch55. Several conformers of all-trans retinoic acid (RA) are well superimposed on the almost non-flexible Fv80, RA, 9-cis RA, and, specifically s-10,12 cis RA. And a simple hexangular model of RA is suggested to draw RA conformers easily without computer drawing model or molecular model.

• 한국산업융합학회 논문집
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• 제5권2호
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• pp.147-152
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• 2002

Because of the difference of the relative reactivity between two hydroxyl groups of the hydroquinone due to the steric hindrance of the substituent, many combinations of the substituent direction in the polyesters derived from asymmetrical diphenols such as monosubstituted hydroquinones was expected. It was studied how the mode of the direction affected the properties of the resulting polyesters in terms of the transition temperatures of the thermotropic polyesters prepared from terephthalic acid, 2,4-dichloroterephthalic acid, and phenylhydroquinone by the reaction using p-Toluenesulfonylchloride in pyridine. The direction was tried to control the relative reactivity by changing the reaction temperature and addition time of the hydroquinone, and by modifying it through an association of the hydroquinones with DMF.

• 폴리머
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• 제35권6호
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• pp.593-598
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• 2011

본 연구에서는 전바나듐 레독스-흐름 전지용 음이온교환막의 제조를 위하여 isophthalic acid (IPA), 1,6-hexanediol(HDO), terephthalic acid(TPA), maleic anhydride(MA)의 용융 축합중합 방법에 의해 IPA-co-HDO-co-(TPA/MA)(IHTM) 공중합체를 합성하였다. 합성된 IHTM 공중합체 아민화 반응을 trimethylamine으로 하였으며, UV 가교 반응을 통하여 음이온교환막을 제조하였다. IHTM 공중합체의 구조 및 열안정성을 FTIR, $^1H$ NMR, TGA 분석을 통하여 확인하였다. 또한 IHTM 음이온교환막의 함수율, 이온교환용량, 전기저항, 전기전도도를 중량법, 적정법 및 LCR 미터로 측정하였으며, 전바나듐 레독스-흐름 전지의 효율 실험을 하였다. 막의 이온교환용량, 전기저항, 전기전도도는 각각 1.10 meq/g, $1.98{\Omega}{\cdot}cm^2$, 0.009 S/cm로 우수하게 나타났으며, 전바나듐 레독스-흐름 전지의 충 방전효율, 전압효율 및 에너지효율은 각각 96.5, 74.6, 70.0%이었다.

• Korean Chemical Engineering Research
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• 제46권6호
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• pp.1130-1134
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• 2008

아세트산은 테레프탈산 제조 공정에서 용매로 사용되며, 사용된 아세트산은 반응 후 증류 공정을 통하여 분리 회수된다. 그러나 소량의 아세트산은 그대로 폐수에 유입되어 버려지는데, 흡착공정을 이용하면 소량의 아세트산을 회수하여 다시 재사용할 수 있다. 본 연구에서는 활성탄을 아세트산 흡착제로 활용하여 상용활성탄의 아세트산 흡착능과 흡착능에 대한 온도 및 흡착제 산처리 효과를 살펴보았다. 활성탄의 아세트산 흡착능은 흡착 키네틱 실험으로 관찰한 결과, 303 K에서는 0.176 mmol/g의 흡착능을 보였으나, 343 K에서는 0.118 mmol/g으로 흡착능이 떨어졌다. 즉, 온도가 증가하면 활성탄의 아세트산 흡착능은 감소하는 결과가 나타났다. 산처리실험에서는 활성탄 표면을 염산 혹은 옥살산으로 처리할 경우, 활성탄의 아세트산 흡착능이 소폭 증가하였다. 이는 산처리로 인해 활성탄 표면에 카르복실산, 혹은 페놀 수산화기 등 표면 관능기가 증가하였기 때문인 것으로 보인다. 아세트산 탈착 실험에서는 정량분석결과, 흡착된 아세트산의 89% 정도가 탈착되었다.

• Macromolecular Research
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• 제17권3호
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• pp.149-155
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• 2009

The thermal decomposition behavior and degradation characteristics off our different thermotropic liquid crystalline polymers (TLCPs) were studied. The thermal decomposition behavior was determined by means of thermogravimetric analysis (TGA) at different heating rates in nitrogen and air. The order of the thermal stability was as follows: multi-aromatic polyester > hydroxybenzoic acid (HBA)/hydroxynaphthoic acid (HNA) copolyester > HNA/hydroxyl acetaniline (HAA)/terephthalic acid (TA) copolyester > HBA/Poly(ethylene terephthalate) (PET) copolyester. The activation energies of the thermal degradation were calculated by four multiple heating rate methods: Flynn-Wall, Friedman, Kissinger, and Kim-Park. The Flynn-Wall and Kim-Park methods were the most suitable methods to calculate the activation energy. Samples were exposed to an accelerated degradation test (ADT), under fixed conditions of heat ($63{\pm}3^{\circ}C$), humidity ($30{\pm}4%$) and Xenon arc radiation ($1.10\;W/m^2$), and the changes in surface morphology and color difference with time were determined. The TLCPs decomposed, discolored and cracked upon exposure to ultraviolet radiation.

• 한국섬유공학회:학술대회논문집
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• 한국섬유공학회 2003년도 봄 학술발표회 논문집
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• pp.335-336
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• 2003

The synthesis of poly(trimethylene terephthalate) (PTT), whose application is being expanded very rapidly to new apparel and carpet materials, was investigated by melt condensation polymerization using 1,3-propanediol (PDO) and terephthalic acid (TPA). No catalyst was used in the 1st step reaction (esterification), but tetrabutyl titanate(TBT) was used as a polyesterification catalyst ranging from 25 to 75 ppm based on the weight of TPA used in the 2nd step reaction (polyesterification). The molar ratio of PDO to TPA was set as 2.2:1. The effect of reaction conditions on the color and intrinsic viscosity of the final product was investigated. (omitted)

• 제어로봇시스템학회:학술대회논문집
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• 제어로봇시스템학회 2004년도 ICCAS
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• pp.377-382
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• 2004

This paper presents a novel optimization method for the air- and gas-supplying network comprised of several air compression systems and air and gas streams in an industrial chemical plant. The optimization is based on the hybrid model developed by Han and $Han^1$ for predicting the power consumption of a compression system. A constrained optimization problem was formulated to minimize the total electric power consumption of all the compression systems in the air- and gas-supplying network under various operating constraints and was solved using a successive quadratic optimization algorithm. The optimization approach was applied to an industrial terephthalic acid manufacturing plant to achieve about 10% reduction in the total electric power consumption under varying ambient conditions.