Chemistry Commons^™

Fundamental Properties Of Colloidal Unimolecular Polymer Particles, Minghang Chen

Doctoral Dissertations

"Colloidal Unimolecular Polymer (CUP) particles are a new genre of material formed by self-assembly into spheroidal particles due to the effect of hydrophilic/hydrophobic interactions of the polymer with a change in the solvent. The particle sizes were characterized by means of Dynamic Light Scattering with corrected viscosities instead of water's viscosity. The distribution of particle size agreed well with the distribution of molecular weight proving that the polymer had undergone unimolecular collapse. The rheology study shows the presence of surface water and its significant effect on the rheology. The primary and secondary electroviscous effects were also found to play roles …

Part I: Increased Leaching Of Arsenic, Selenium, Molybdenum, And Vanadium From High Calcium Coal Ash Containing Trona Reaction Products. Part Ii: Using Agricultural Byproduct Rice Hull As Biosorbent To Remove And Recover Metal Ions In Water, Yongbo Dan

Masters Theses

"Part I. The trona is being injected to control SO_x emission from coal-fired power plants. The results showed that trona ash leached significantly more As, Se, Mo, and V than the control fly ash did, especially under the natural pH condition. In addition, trona ash had a significantly greater soluble fraction than the control ash. Further investigation indicated that greater amounts of the studied anionic elements in the trona ash were associated with the soluble, trona reaction products. Moreover, the insoluble fraction of the trona ash lost its capability to adsorb these elements under the natural pH condition. The …

Comparative Evaluation Of N-Acetylcysteine And N-Acetylcysteine Amide In Acetaminophen-Induced Oxidative Stress, Ahdab Naeem Khayyat

Masters Theses

"Acetaminophen (APAP) is the most widely used pharmaceutical analgesic-antipyretic agent in the world, but its toxicity is a common cause of drug-induced hepatotoxicity. With APAP toxicity, cellular glutathione (GSH) is depleted. This results in the availability of N-acetyl-p-benzoquinone imine (NAPQI), is a toxic metabolite of APAP that binds to cellular macromolecules, which leads to cell necrosis. N-acetyl cysteine (NAC), a GSH precursor, is the only approved antidote for an acetaminophen overdose. It is a negatively charged molecule that diminishes its penetration into the cells, thereby requiring fairly high doses that increase the severity of side effects. In addition, oral and …

Role Of Nicotine In Oxidative Stress, Rakesh Kacham

Masters Theses

"Nicotine, a major alkaloid, is present in tobacco products as well as in smaller amounts in potatoes, tomatoes, and eggplants. Although it is the addictive compound in cigarettes, nicotine is believed to play a protective role in neurodegenerative disorders such as Parkinson's disease. Researchers have found that the short-term administration of nicotine may help improve the memory process by reducing oxidative stress in the brain. Our studies have shown that, by blocking Fenton's reaction, nicotine is able to inhibit free radical generation, so this research has focused on the antioxidant properties of nicotine. The cell lines of the alveoli, blood …

Synthesis Of 5-Membered Heterocycles Using Benzoylacetonitriles As Synthon, Rizk Elsayed Khidre, Bakr Fathy Abdelwahab

Turkish Journal of Chemistry

This review article represents a survey covering the synthetic strategies leading to 5-membered heterocycles. The reactions are subdivided into groups that cover the synthetic methods of those heterocycles, i.e. pyrroles, furans, thiophenes, pyrazoles, isoxazoles, thiazoles, and others, utilizing benzoylacetonitriles as starting precursor from 1985 up to the present. The reactions are subdivided into groups that cover the synthetic methods for those heterocycles from benzoylacetonitriles.

Determination Of Zineb In Tap Water And Tomato Samples By Adsorptive Catalytic Stripping Voltammetry, Özlem Karakoç, Nuri̇ Naki̇boğlu

Turkish Journal of Chemistry

This paper describes a sensitive and accurate adsorptive catalytic stripping voltammetric method for the determination of zineb (zinc ethylene-bis- dithiocarbamate) in tap water and tomato samples. The method is based on the reduction of adsorbed zineb at a hanging mercury drop electrode following its catalytic oxidation using peroxydisulfate as an oxidizing reagent. Chemical and instrumental parameters of the process were optimized. The catalytic mechanism of the reduction of zineb is discussed as well. The limits of detection (3 s) and quantification (10 s) and linear range of the method for accumulation time of 60 s were calculated as 8.1 nM, …

Determination And Evaluation Of Gross Alpha And Beta Activity Concentrations And Metal Levels In Thermal Waters From Ankara, Turkey, Orhan Acar, Orhan Murat Kalfa, Özcan Yalçinkaya, Ali̇ Rehber Türker

Turkish Journal of Chemistry

The gross \alpha and \beta activity concentrations in the thermal waters of Karakaya-Ayaş, İçmece-Ayaş, Beypazarı (Dutluk-Tahtalı), Haymana, and Kızılcahamam spas in Ankara Province were measured by MPC-9604 multi-detector \alpha /\beta counting system. Ranges of activity concentrations found were from 0.09 to 2.58 Bq L^{-1} for gross \alpha and from 0.25 to 2.61 Bq L^{-1} for gross \beta . The ranges of minimum detectable concentrations for gross \alpha (0.05--0.41 Bq L^{-1}) and for gross \beta (0.04--0.29 Bq L^{-1}) were obtained. Gross \alpha and \beta activity concentrations found in samples were compared with the recommended guidelines of the World Health Organization and …

Synthesis, Characterization, And Fluorescence Study Of Phthalhydrazidylazo Derivative Of An Unsaturated Diketone And Its Metal Complexes, Radhika Pallikkavil, Muhammed Basheer Ummathur, Krishnannair Krishnankutty

Turkish Journal of Chemistry

The coupling of diazotized luminol with the unsaturated diketone 1,7-diphenylhepta-4,6-diene-1,3-dione yielded a new type of tridentate ligand (H_2L). Analytical, IR, ^1H NMR, and mass spectral data indicate the existence of the compound in the intramolecularly hydrogen-bonded keto-hydrazone tautomeric form. Dibasic tridentate coordination of the compound in its [ML(H_2O)] complexes [M = Cu(II), Ni(II) and Zn(II)] was established on the basis of analytical and spectral data. The Ni(II) and Zn(II) chelates are diamagnetic while Cu(II) complex showed normal paramagnetic moment. The fluorescence maxima of the compound in different solvents show that the emission wavelength increases with increases in the polarity of …

Novel Flame Retardant Poly(Thiourea-Sulfone-Imide)S For High Temperature Applications: Synthesis And Characterization, Ghulam Waris, Humaira Masood Siddiqi, Lance Twyman, Rizwan Hussain, Zareen Akhter, Muhammad Saeed Butt

Turkish Journal of Chemistry

The synthesis and polymerization of a novel diamine monomer, 1,1-(sulfonylbis (4,1-phenylene)) bis (thiourea) (SPT), with various aromatic dianhydrides were carried out. In addition, the fabrication of poly(thiourea-sulfone-imide)s (PTSIs) with noble thermal properties and flame retardancy was conducted. The structures of SPT and polymers were characterized by FT-IR, ^1H NMR, and ^{13}C NMR spectroscopy along with elemental analysis. Crystallinity, organosolubility, inherent viscosity, and gel permeation chromatographic measurements were taken as well. The amorphous nature was exhibited by PTSIs containing C=S and --SO_2- moieties in the backbone that were readily soluble in highly polar organic solvents. The inherent viscosities of PTSIs were …

Synthesis And Characterization Of Thermally Stable Camphor-Based Polyimide--Clay Nanocomposites, Murat Yi̇ği̇t, Turgay Seçki̇n, Beyhan Yi̇ği̇t, Süleyman Köytepe

Turkish Journal of Chemistry

A new monomer was prepared from (1R,3S)-(+)-camphoric acid. Novel polyimide and polyimide--clay hybrid composites were developed from one-pot condensation reactions of this monomer and pyromellitic dianhyride. Polyimide-montmorillonite nanocomposites were prepared from solution of polyimide and with different weight percentages (1, 5, 10 wt %) of organo-modified montmorillonite (OM-MMT) using N-methyl-2-pyrrolidone (NMP) as aprotic solvent. The reactive organoclay was formed by using hexadecylpyridinium chloride as a swelling agent for silicate layers of montmorillonite. The polyimide--clay composites films (PI--MMT) were characterized by Fourier transform infrared spectroscopy, scanning electron microscopy (SEM), and X-ray diffraction (XRD). All composites were subjected to differential scanning calorimetry …

Ionic Liquid Mediated Synthesis, Reactions, And Insecticidal Activity Of 1-[(1h-Benzoimidazol-2-Yl)Amino]Spiro[Azetidine-4,4'-[4'H]Chroman]-2-Ones, Dr Kanti Sharma, Renuka Jain

Turkish Journal of Chemistry

Ionic liquid mediated synthesis of novel heterocyclic compounds 1-[(1H-benzoimidazol-2-yl)amino]-2'-phenylspiro[azetidine- 4,4'-[4'H]chroman]-2-ones (3) and 1-[(1H-benzoimidazol-2-yl)amino]- 3-chloro-2'-phenylspiro[aze tidine-4,4'-[4'H] chroman]-2-ones (4) was accomplished by condensing substituted 2-hydrazino benzimidazole (1), flavanone (2), and acetyl chloride/chloroacetyl chloride in ionic liquid, [bmim]PF_6 with or without using catalyst in excellent yield (90%--95%). Further, compounds 3 and 4 were acylated with trifluoroacetic anhydride to give N-acylated products (5 and 10); 3 when treated with HCHO and (C_2H_5)_2NH gave Mannich bases (6) and with aldehydes afforded 3-arylidene-2-azetidinone (7). Compounds 4 underwent nucleophilic substitution with (i) KI (Finkelstein reaction) and (ii) phenols to give the corresponding iodo and phenoxy derivatives (8 …

Synthesis And Evaluation Of Acetylcholineesterase Inhibitory Potential And Antioxidant Activity Of Benzothiazine Derivatives, Durre Shahwar, Uzma Sana, Naeem Ahmad

Turkish Journal of Chemistry

The aim of the present study was to synthesize and characterize benzothiazine derivatives prepared by using 2-aminothiophenol and saccharine and in vitro screen their enzyme inhibition and antioxidant potential. Nine different derivatives were prepared and their structures were confirmed by spectral studies (EIMS, ^1 H and ^{13}C NMR). Enzyme inhibition potential of the synthesized compounds was evaluated by Ellman's method, while antioxidant activity was determined by DPPH and FRAP assays. All the derivatives showed remarkable activity against acetylcholine esterase with IC_{50} values in the range of 35.9--122.0 \mu M. All other derivatives, except compound 4a, were inactive towards DPPH radical. …

Synthesis And Antimicrobial Investigation Of Some 5h-Pyridazino[4,5-B]Indoles, İlker Avan, Alaetti̇n Güven, Kiymet Güven

Turkish Journal of Chemistry

Synthesis and in vitro antimicrobial activities are reported for a series of 1,3,5-substituted 4-oxo-3,4-dihydro-5H-pyridazino[4,5-b]indole derivatives. Corresponding pyridazino[4,5-b]indoles were prepared from ethyl 3-formyl-1H-indole-2-carboxylate precursors and the functional group in question was installed with hydrazine and its derivatives. The purity and primary structures of pyridazino[4,5-b]indole were confirmed by IR, ^1 H NMR, and ^{13}C NMR spectroscopy and elemental analyses. All of the indoles were tested for in vitro antimicrobial activity against 8 isolates of bacteria and a fungus including Staphylococcus aureus NRRL B-767, Escherichia coli ATCC 25922, Pseudomonas aeruginosa ATCC 27853, Proteus vulgaris NRRL-B123, Salmonella typhimurium NRRL B-4420, Bacillus subtilis NRRL 744, …

Flavonoid Constituents Of Sideritis Caesarea, Belkis Halfon, Ece Çi̇ftçi̇, Gülaçti Topçu

Turkish Journal of Chemistry

The acetone extract of the aerial parts of Sideritis caesarea Duman, Aytaç & Başer (Lamiaceae) afforded the flavonoids penduletin (1) and apigenin (2) and 6 glycosylated flavonoids, 4'-O-methyl-isoscutellarein-7-O-[6'''-O-acetyl-\beta-D-allopyranosyl- (1 \to 2)]-6\"-O-acetyl-\beta -D-glucopyranoside (3), 4'-O-methylhypolaetin- 7-O-[6'''-O-acetyl-\beta -D-allopyranosyl-(1 \to 2)]-6\"-O-acetyl-\beta- D-glucopyranoside (4), isoscutellarein-7-O-[6'''-O-acetyl-\beta- D-allopyranosyl-(1 \to 2)]-6\"-O-acetyl-\beta -D-glucopyranoside (5), isoscutellarein-7-O-[6'''-O-acetyl-\beta -D-allopyranosyl-(1 \to 2)]- \beta-D-glucopyranoside (6), 4'-O-methylhypolaetin-7-O- [6'''-O-acetyl-\beta -D-allopyranosyl-(1 \to 2)]-\beta-D- glucopyranoside (7), and hypolaetin-7-O-[6'''-O-acetyl-\beta- D-allopyranosyl-(1 \to 2)]-\beta -D-glucopyranoside (8). The compounds were identified by the use of 1D- and 2D-NMR and UV spectroscopic techniques and by comparisons with the reported data. The acetylcholinesterase (AChE) and butyrylcholinesterase (BChE) inhibitory activities of the acetone, methanol, …

Umpolung Strategy: Advances In Catalytic C-C Bond Formations, Serkan Eymur, Mehmet Göllü, Ci̇hangi̇r Tanyeli̇

Turkish Journal of Chemistry

This mini-review examines the recent advances in umpolung strategy, devised originally by Corey and Seebach. Although numerous stoichiometric variants have been published to date, this article covers just the catalytic C-C bond forming reactions due to their major benefits such as atom economy, less pollution, and workable simplicity. In the context of umpolung, the studies are evaluated under 3 main titles: enzyme, N-heterocyclic carbene, and cyanide ion catalyzed reactions. In particular, enzyme and NHC catalyzed reactions mainly involve asymmetric applications.

Droplet Condensation On Polymer Surfaces: A Review, İkri̇me Orkan Uçar, Hüsnü Yildirim Erbi̇l

Turkish Journal of Chemistry

Dropwise condensation on substrates is an important topic of interest because it plays a crucial role in many scientific applications such as heat transfer, water harvesting from the humid atmosphere, and polymer templating. We focused on droplet condensation on polymer surfaces and briefly summarized the drop condensation studies reported in the last 2 decades and their potential applications. The main topics discussed in this review are water harvesting from dew using radiative cooling; using surfaces synthesized by bio-inspiration; experimental, theoretical, and simulation studies on the growth of breath figures; drop condensation on superhydrophobic surfaces and on self-assembled monolayers; and hexagonal …

Properties And Structures Of Li-N Based Hydrogen Storage Materials, Junqing Zhang

Dissertations, Master's Theses and Master's Reports - Open

Traditional transportation fuel, petroleum, is limited and nonrenewable, and it also causes pollutions. Hydrogen is considered one of the best alternative fuels for transportation. The key issue for using hydrogen as fuel for transportation is hydrogen storage. Lithium nitride (Li3N) is an important material which can be used for hydrogen storage. The decompositions of lithium amide (LiNH2) and lithium imide (Li2NH) are important steps for hydrogen storage in Li3N. The effect of anions (e.g. Cl-) on the decomposition of LiNH2 has never been studied. Li3N can react with LiBr to form lithium nitride bromide Li13N4Br which has been proposed as …

Modern Computational Chemistry Methods For Prediction Of Ground- And Excited-State Properties In Open-Shell Systems, Nina Tyminska

Dissertations, Master's Theses and Master's Reports - Open

The main goal of the research presented in this work is to provide some important insights about computational modeling of open-shell species. Such projects are: the investigation of the size-extensivity error in Equation-of-Motion Coupled Cluster methods, the analysis of the Long-Range corrected scheme in predicting UV-Vis spectra of Cu(II) complexes with the 4-imidazole acetate and its ethylated derivative, and the exploration of the importance of choosing a proper basis set for the description of systems such as the lithium monoxide anion. The most significant findings of this research are: (i) The contribution of the left operator to the size-extensivity error …

Parametric Study Of Reaxff Simulation Parameters For Molecular Dynamics Modeling Of Reactive Carbon Gases, Benjamin David Jensen

Dissertations, Master's Theses and Master's Reports - Open

Abstract

Oligodeoxynucleotide Synthesis Using Protecting Groups And A Linker Cleavable Under Non-Nucleophilic Conditions, Xi Lin

Dissertations, Master's Theses and Master's Reports - Open

Oligodeoxynucleotides (ODNs) containing latent electrophilic groups can be highly useful in antisense drug development and many other applications such as chemical biology and medicine, where covalent cross-linking of ODNs with mRNA, protein and ODN is required. However, such ODN analogues cannot be synthesized using traditional technologies due to the strongly nucleophilic conditions used in traditional deprotection/cleavage process.

To solve this long lasting and highly challenging problem in nucleic acid chemistry, I used the 1,3-dithian-2-yl-methoxycarbonyl (Dmoc) function to protect the exo-amino groups on the nucleobases dA, dC and dG, and to design the linker between the nascent ODN and solid support. …

Development And Characterization Of Fluorescent Ph Sensors Based On Porous Silica And Hydrogel Support Matrices, Qili Hu

Dissertations, Master's Theses and Master's Reports - Open

The hydrogen ion activity (pH) is a very important parameter in environment monitoring, biomedical research and other applications. Optical pH sensors have several advantages over traditional potentiometric pH measurement, such as high sensitivity, no need of constant calibration, easy for miniaturization and possibility for remote sensing. Several pH indicators has been successfully immobilized in three different solid porous materials to use as pH sensing probes.

The fluorescent pH indicator fluorescein-5-isothiocyanate (FITC) was covalently bound onto the internal surface of porous silica (pore size ~10 nm) and retained its pH sensitivity. The excited state pK* _a of FITC in porous silica …

Studies Of Functionalized Nanoparticles For Smart Self-Assembly And As Controlled Drug Delivery, Xiaochu Ding

Dissertations, Master's Theses and Master's Reports - Open

This dissertation is related to the studies of functionalized nanoparticles for self-assembly and as controlled drug delivery system. The whole topic is composed of two parts. In the first part, the research was conducted to design and synthesize a new type of ionic peptide-functionalized copolymer conjugates for self-assembly into nanoparticle fibers and 3D scaffolds with the ability of multi-drug loading and governing the release rate of each drug for tissue engineering. The self-assembly study confirmed that such peptide-functionalized amphiphilic copolymers underwent different self-assembly behavior. The bigger nanoparticles were more easily assembled into nanoparticle fibers and 3D scaffolds with larger pore …

Reality Of Chemistry Is Far From Stereotypes, Aldemaro Romero Jr.

Publications and Research

No abstract provided.

Chemist Breaks With The Usual Stereotypes, Aldemaro Romero Jr.

Publications and Research

No abstract provided.

Purification Of Sodium Sulfate By Crystallization, Perla Teresita Torres

Open Access Theses & Dissertations

Sodium sulfate can be recovered from a dilute solution by concentrating it by conventional water treatment techniques like reverse osmosis and electrodialysis; however, those processes also concentrate impurities like arsenic. The sodium sulfate would have commercial use if it can be recovered in an arsenic-free form. This study demonstrated that sodium sulfate could be separated from impurities using slow cooling crystallization in a novel apparatus developed and designed during the experimentation. This device is called a heat exchanger crystallizer and allows slow cooling crystallization in order to grow pure crystals of sodium sulfate decahydrate. Crystals grown in the heat exchanger …

Study Of The Reaction Of Nitriles With Dialkyl Phosphites For Synthesis Of A-Amino-Bis-Phosphonates, Prasanna Vanja

Master's Theses and Doctoral Dissertations

Amino bisphosphonate compounds are found in a vast array of products from water chelators to flame retardants to pharmaceuticals. Previous methods to synthesize these compounds involved the use of protic acids, which don’t provide ideal conditions for the starting materials containing acid labile functional groups in pharmaceutical compounds. The present study adopts a new synthetic route in which diethyl phosphite addition to the nitrile would be effected in the presence of a Lewis acid catalyst. This study utilized lanthanum trifluoromethane sulfonate as the Lewis acid catalyst, facilitating the addition of the P-H bond across the nitrile triple bond. Product purification …

An Acid Catalyzed Reversible Ring-Opening/Ring-Closure Reaction Involving A Cyano-Rhodamine Spirolactam, H. Li, H. Guan, X. Duan, J. Hu, Guiren Wang, Qian Wang

Faculty Publications

Cyanamide was introduced into the rhodamine spirolactam framework to produce a colorless and non-fluorescent compound RBCN. It shows a reversible ring-opening/ring-closure process in response to the solution pH, which exhibits an “ON/OFF” switching in its fluorescence. Different from other rhodamine-type dyes, the ring-open form of RBCN is stable in protic solvents under neutral, near neutral and basic conditions, showing a pink color and very strong fluorescence. We also demonstrated the potential of RBCN in live cell imaging.

The Synthesis And Characterization Of 1,3-Bisphenylsulfonylacetone, 2,5-Dicarboethoxy-3,4-Di(4-Methylphenyl)Cyclopentadienone Dimer, And Dp-Ppv Polymers And Oligomers, Mark Robert Duffy

Browse all Theses and Dissertations

An SN2 reaction between 1,3-dichloroacetone and benzenesulfinic acid sodium salt was carried out to produce 1,3-bis(phenylsulfonyl)acetone. A crystal structure for 1,3-bis(phenylsulfonyl)acetone was obtained. The SN2 reaction was followed by a condensation reaction with benzil but this did not yield a condensation product. A photo-active compound, 2,5-dicarboethoxy-3,4-di(4-methylphenyl)cyclopentadienone, was synthesized and was shown to undergo a unique, solid-state dimerization. Several reactions involving the ester functions were carried out but these did not yield the expected products, instead, structural rearrangements seemed to predominate. An asymmetric cyclopentadienone, 2-carbomethoxy-5-methyl-3,4-diphenylcyclopentadienone, was synthesized and it was reacted with norbornadiene to produce methyl 4-methyl-2,3-diphenylbenzoate. The benzoate was reduced …

Concerted And Sequential Pathways Of Proton-Coupled Electron Transfer In Hydrogen Halide Elimination, Aimable Kalume, Lisa George, Nicole Cunningham, Scott A. Reid

Chemistry Faculty Research and Publications

Proton-coupled electron transfer (PCET) is a key reaction in a diverse array of chemical and biochemical processes. Concerted PCET, a single step process where no intermediates are expected, is often difficult to distinguish from sequential electron transfer/proton transfer (or proton transfer/electron transfer) events that involve one or more reactive intermediates. Here we demonstrate that in an apparently simple and fundamental organic reaction, hydrogen halide elimination (dehydrohalogenation), both mechanisms occur, with concerted PCET kinetically favored over sequential ET/PT. The latter involves a well-defined reactive intermediate, the corresponding iso-halon.

Production Mechanisms, Number Concentration, Size Distribution, Chemical Composition, And Optical Properties Of Sea Spray Aerosols, Nicholas Meskhidze, Markus D. Petters, Kostas Tsigaridis, Tim Bates, Colin O'Dowd, Jeff Reid, Ernie R. Lewis, Brett Gantt, Magdalena D. Anguelova, Prakash V. Bhave, Andrew Wozniak

Chemistry & Biochemistry Faculty Publications

(First paragraph)

The impact of sea spray aerosols on global climate remains one of the most uncertain components of the aerosol–radiation–climate problem, but has received less attention than the impacts of terrestrial and anthropogenic aerosols. The last decade has produced a large body of information regarding the sources and composition of marine aerosols, resulting in a reassessment of the complex role that sea spray particles play in climate and various geophysical phenomena. As sea spray aerosol contributes substantially to the preindustrial, natural background which provides the baseline on top of which anthropogenic forcing should be quantified, and because the ocean …