• 제목/요약/키워드: Thermodynamic Parameters

검색결과 495건 처리시간 0.024초

Taxus chinensis로부터 파클리탁셀 정제를 위한 개선된 아세톤-물 분별침전 공정 개발 및 그 동역학 및 열역학적 해석 (Development of An Improved Acetone-Water Fractional Precipitation Process for Purification of Paclitaxel from Taxus chinensis and Its Kinetic and Thermodynamic Analysis)

  • 강회종;김진현
    • Korean Chemical Engineering Research
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    • 제59권3호
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    • pp.379-392
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    • 2021
  • 본 연구에서는 초음파 캐비태이션 버블와 가스 버블를 이용한 파클리탁셀의 개선된 아세톤-물 분별침전 공정을 개발하였다. 전통적 방법에 비해 침전에 소요되는 시간이 20~25배 단축되었다. 또한 파클리탁셀의 침전물 크기는 3.5~5.5배 감소하였으며 파클리탁셀의 확산 계수는 3.5~6.7배 증가하였다. 초음파 캐비태이션 버블을 이용한 침전의 경우 초음파 파워는 증가할수록, 침전 온도는 감소할수록 침전 속도 상수는 증가하였다. 가스 버블을 이용한 침전의 경우 가스 유량은 증가할수록, 침전 온도는 감소할수록 침전 속도 상수는 증가하였다. 열역학적 해석을 통해 개선된 분별침전은 비자발적 발열 공정이었다.

Fluoran계 염료의 열변색 현상에 관한 열역학적 분석 (A thermodynamic analysis on thermochromism of fluoran dyes)

  • 김재욱;지명진;김종규
    • 분석과학
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    • 제22권2호
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    • pp.159-165
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    • 2009
  • 기능성 염료의 일종인 fluoran계 염료의 열 변색현상으로부터 열역학적인 함수들을 구하였다. 양성자성 용매와 비양성자성 용매에서 온도변화에 따른 UV-Vis 스펙트럼을 측정함으로서 평형상수와 엔탈피 값을 측정하였다. 양성자성 용매에서는 락톤형으로만 존재하나 비양성자성 용매에서는 락톤형과 쯔비터 이온형이 같이 존재함을 확인하였다. 평형 상수를 결정하는 요인은 용매의 극성도가 아니라 수소결합 주게의 성질에 큰 영향을 받음을 확인하였다. 엔탈피 변화량도 측정하였다. 온도 변화에 따라 열 변색 현상이 잘 일어나므로 엔탈피 변화량은 약 -2.0 kJ/mol정도이며, 따라서 열린형이 닫힌형보다도 에너지가 안정함을 확인하였다. 산에 의한 엔탈피 변화량은 양성자성 용매에서는 거의 0 kJ/mol에 가까우며 비양성자성 용매에서는 일정한 경향성을 찾기 어려웠으며. 또한 엔트로피와 깁스 자유에너지도 일정한 경향성을 보이지 않았다. 이러한 열역학적인 분석 결과는 기능성 염료의 디자인이나 합성에서 중요한 정보를 제공할 수 있다.

The Error of the Method of Angular Sections of Microwave Sounding of Natural Environments in the System of Geoecological Monitoring

  • Fedoseeva, E.V.;Kuzichkin, O. R.
    • International Journal of Computer Science & Network Security
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    • 제21권6호
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    • pp.47-53
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    • 2021
  • The article deals with the problems of application of microwave methods in systems of geoecological monitoring of natural environments and resources of the agro-industrial complex. It is noted that the methods of microwave radiometry make it possible, by the power of the measured intrinsic radio-thermal radiation of the atmosphere, when solving inverse problems using empirical and semi-empirical models, to determine such parameters of the atmosphere as thermodynamic temperature, humidity, water content, moisture content, precipitation intensity, and the presence of different fractions of clouds.In addition to assessing the meteorological parameters of the atmosphere and the geophysical parameters of the underlying surface based on the data of microwave radiometric measurements, it is possible to promptly detect and study pollution of both the atmosphere and the earth's surface. A technique has been developed for the analysis of sources of measurement error and their numerical evaluation, because they have a significant effect on the accuracy of solving inverse problems of reconstructing the values of the physical parameters of the probed media.To analyze the degree of influence of the limited spatial selectivity of the antenna of the microwave radiometric system on the measurement error, we calculated the relative measurement error of the ratio of radio brightness contrasts in two angular directions. It has been determined that in the system of geoecological monitoring of natural environments, the effect of background noise is maximal with small changes in the radiobrightness temperature during angular scanning and high sensitivity of the receiving equipment.

Self-Assembly of Triblock Copolymers in Melts and Solutions

  • Kim, Seung-Hyun;Jo, Won-Ho
    • Macromolecular Research
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    • 제9권4호
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    • pp.185-196
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    • 2001
  • The self-assembly of block copolymers can lead to a variety of ordered structures on a nanometer scale. In this article, the self-assembling behaviors of triblock copolymers in the melt and the selective solvent are described with the results obtained from the computer simulations. With the advances of computing power, computer simulations using molecular dynamics and Monte Carlo techniques make it possible to study very complicated phenomena observed in the self-assembly of triblock copolymer. 13king full advantage of the computer simulation based on well-defined model, the effects of various structural and thermodynamic parameters such as the copolymer composition, the block sequence, the pairwise interaction energies, and temperature on the self-assembly are discussed in some detail. Some simulation results are compared with experimental ones End analyzed by comparing them with the theoretical treatment.

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An Investigation on the Tetrahydropyrimidine Derivatives as Acid Corrosion Inhibitors for Mild Steel

  • Chitra, S.;Gayathri, N.;Parameswari, K.
    • Corrosion Science and Technology
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    • 제8권2호
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    • pp.45-52
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    • 2009
  • The corrosive behavior of mild steel in 0.05 M to 10 M $H_2SO_4$ solutions containing different concentrations of tetrahydropyrimidine derivatives (THPM) was investigated using weight loss method, gasometric technique, electrochemical studies which include AC - impedance and potentiodynamic polarization method, atomic absorption studies and synergistic effect. The results obtained reveal that THPM derivatives is an efficient mixed type inhibitor but slightly anodic and it is more effective in reducing corrosion of mild steel in $H_2SO_4$ media. The adsorption of the inhibitor on the mild steel surface obeys the Langmuir adsorption isotherm. The thermodynamic parameters of adsorption reveal a strong interaction and spontaneous adsorption of THPM on the mild steel surface. The influence of temperature and inhibitor concentration on the corrosion of mild steel has also been investigated.

VS계 반응염료 가수분해반응의 열역학적 해석 (Thermodynamic Analysis on the Hydrolysis Reaction of Vinylsulfonyl Reactive Dyes)

  • 권혁성;전영실;남성우;김인회
    • 한국염색가공학회:학술대회논문집
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    • 한국염색가공학회 2008년도 제38차 학술발표대회
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    • pp.74-76
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    • 2008
  • The hydrolyses of ten VS dyes were examined at 40$^{\circ}C$, 50$^{\circ}C$, and 60$^{\circ}C$ and the kinetic parameters were estimated. The values of free energy, enthalpy and entropy of hydrolysis and reaction with cellulose for VS dyes were calculated. The linear relationship exist between the enthalpy and entropy. The structure and entropy of VS dyes gave a effect on the dimerization for VS reactive dyes. The VS dyes have small value of entropy were formed dimer. It was confirmed that no dimer form for m-substituted VS dyes. There were similarities among various reactions including homo- and mixed dimerization.

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Pharmaceutical studies on the polymorphism of hydrochlorothiazide

  • Kim, Bong-Hee;Kim, Johng-Kap
    • Archives of Pharmacal Research
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    • 제7권1호
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    • pp.47-52
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    • 1984
  • Four polymorphic forms (I, II, III and IV) of hydrochlorothiazide have been characterized on the basis of x-ray diffractometry and differential thermal analysis. Form I was obtained by crystallization from N, N-dimethylformamide and Form II was crystallized from hot methanol. Form III was precipitated from sodium hydroxide aqueous solution by treatment with hydrochloric acid and Form IV was crystallized from 50% methanol. The metastable form I was a most stable form among four polymorphs, which was stable more than ten months at room temperature. The thermodynamic parameters such as heat of solution, enthalpy, entropy, free energy difference and transition temperature were determined by the measurement of intrinsic dissolution rate. The transition temperature and the heat of transition between the metastable Form I an Form II were determined to be $299.15^{\circ}$K and 5.03 Kcal/mole, respectively and free energy difference ($\delta$ F) was 302. 13 cal/mole. Diuretic action of these four polymorphic forms was also evaluated by monitoring the difference in urinary excretion of sodium, potassium and magnesium in rats.

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Lornoxicam & Tenoxicam Drugs as Green Corrosion Inhibitors for Carbon Steel in 1 M H2SO4 Solution

  • Fouda, A.S.;El-Defrawy, A.M.;El-Sherbeni, M.W.
    • Journal of Electrochemical Science and Technology
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    • 제4권2호
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    • pp.47-56
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    • 2013
  • Inhibition performance of Lornoxicam & Tenoxicam against corrosion of carbon steel in 1M $H_2SO_4$ solutions was investigated by weight loss, potentiodynamic polarization and electrochemical impedance spectroscopy (EIS) measurements. The inhibition efficiency increased with increasing inhibitor's concentration, but decreased with increase in temperature. Potentiodynamic polarization curves showed that, the inhibitors were of mixed type. The apparent activation energy ($E^*_a$) and other thermodynamic parameters for the corrosion process have also been calculated and discussed. The inhibition of carbon steel corrosion is due to the adsorption of the inhibitor molecules on the surface, which follows Temkin adsorption isotherm. The mechanism of inhibition was discussed in the light of the chemical structure of the undertaken inhibitors.

Role of Some Phenylthiourea Derivatives as Corrosion Inhibitors for Carbon Steel in HCl Solution

  • Fouda, Abd El-Aziz El-Sayed;Hussein, Ahmed
    • 대한화학회지
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    • 제56권2호
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    • pp.264-273
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    • 2012
  • Five derivatives of phenylthiourea namely: 1-(4-methoxyphenyl)-3-phenylthiourea (1), 1-(4-methylphenyl)-3- phenylthiourea (2), 1-(4-bromophenyl)-3-phenylthiourea (3), 1-(4-chlorophenyl)-3-phenylthiourea (4) and 1-phenylthiourea (5) have been evaluated as new inhibitors for the corrosion of carbon steel in 2 M HCl solution using potentiodynamic polarization and electrochemical impedance spectroscopy (EIS) techniques. Potentiodynamic polarization measurements showed that these derivatives are mixed-type inhibitors. The inhibition efficiency was found to increase with inhibitor concentration and decreases with rise in temperature. The thermodynamic parameters of adsorption and activation were determined and discussed. Nyquist plots showed depressed semicircles with their centre below real axis. The adsorption process of studied derivatives on carbon steel surface obeys Temkin adsorption isotherm. The synergistic effect of these derivatives and some anions is discussed from the viewpoint of adsorption models. The electrochemical results are in good agreement with the calculated quantum chemical HOMO and LUMO energies of the tested molecules.

Electrochemical Adsorption Properties and Inhibition of Zinc Corrosion by Two Chromones in Sulfuric Acid Solutions

  • Fouda, Abd El-Aziz S.;Nazeer, Ahmed Abdel;Saber, Ahmed
    • 대한화학회지
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    • 제58권2호
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    • pp.160-168
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    • 2014
  • The electrochemical behavior and corrosion inhibition of zinc in 0.5 M $H_2SO_4$ in the absence and presence of some chromones has been investigated using weight loss, potentiodynamic polarization, electrochemical impedance spectroscopy (EIS) and electrochemical frequency modulation (EFM) techniques. The presence of these investigated compounds in the corrosive solutions decrease the weight loss, the corrosion current density, and double layer capacitance but increases the charge transfer resistance. Polarization studies were carried out at room temperature, and showed that all the studied compounds act as mixed type inhibitors with a slight predominance of cathodic character. The effect of temperature on corrosion inhibition has been studied and the thermodynamic activation and adsorption parameters were determined and discussed. The adsorption of the investigated compounds on zinc was found to obey Langmuir adsorption isotherm.