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1.
Martien A. Würdemann Cristina Niţu Dr. Stefaan M. A. De Wildeman Dr. Katrien V. Bernaerts Prof. Dr. Romano V. A. Orru 《Chemistry (Weinheim an der Bergstrasse, Germany)》2020,26(36):8090-8100
Pyrazines are an underreported class of N-heterocycles available from nitrogen-rich biomass presenting an interesting functional alternative for current aromatics. In this work, access to pyrazines obtained from amino acids by using the 90 year old Dakin–West reaction was explored. After a qualitative screening several functional proteinogenic amino acids proved good substrates for this reaction, which were successfully scaled to multigram scale synthesis of the corresponding intermediate α-acetamido ketones. Subsequently, the conditions towards pyrazine formation using δ-amino-levulinic acid were optimized, and these were employed to synthesize a relevant set of five functional dimethylpyrazines in high purity. These pyrazines can be considered a versatile toolbox of aromatic building blocks for a wide range of applications, such as in the synthesis of polymers or metal–organic frameworks. 相似文献
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Carboxylic‐Acid‐Passivated Metal Oxide Nanocrystals: Ligand Exchange Characteristics of a New Binding Motif 下载免费PDF全文
Jonathan De Roo Dr. Yolanda Justo Katrien De Keukeleere Freya Van den Broeck Prof. Dr. José C. Martins Prof. Dr. Isabel Van Driessche Prof. Dr. Zeger Hens 《Angewandte Chemie (International ed. in English)》2015,54(22):6488-6491
Ligand exchange is central in the processing of inorganic nanocrystals (NCs) and requires understanding of surface chemistry. Studying sterically stabilized HfO2 and ZrO2 NCs using 1H solution NMR and IR spectroscopy as well as elemental analysis, this paper demonstrates the reversible exchange of initial oleic acid ligands for octylamine and self‐adsorption of oleic acid at NC surfaces. Both processes are incompatible with an X‐type binding motif of carboxylic acids as reported for sulfide and selenide NCs. We argue that this behavior stems from the dissociative adsorption of carboxylic acids at the oxide surface. Both proton and carboxylate moieties must be regarded as X‐type ligands yielding a combined X2 binding motif that allows for self‐adsorption and exchange for L‐type ligands. 相似文献
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A Priori Testing of Flamelet Generated Manifolds for Turbulent Partially Premixed Methane/Air Flames
W. J. S. Ramaekers J. A. van Oijen L. P. H. de Goey 《Flow, Turbulence and Combustion》2010,84(3):439-458
To reduce high computational cost associated with simulations of reacting flows chemistry tabulation methods like the Flamelet
Generated Manifold (FGM) method are commonly used. However, H2, CO and OH predictions in RANS and LES simulations using the FGM (or a similar) method usually show a substantial deviation
from measurements. The goal of this study is to assess the accuracy of low-dimensional FGM databases for the prediction of
these species in turbulent, partially-premixed reacting flows. It will be examined to what extent turbulent, partially-premixed
jet flames can be described by FGM databases based on premixed or counterflow diffusion flamelets and to what extent the chosen
molecular transport model for the flamelet influences the accuracy of species mass fraction predictions in CFD-simulations.
For LES and RANS applications a model that accounts for subgrid fluctuations has to be added introducing additional errors
in numerical results. A priori analysis of FGM databases enables the exclusion of numerical errors (scheme accuracy, convergence) that occur in CFD simulations
as well as the exclusion of errors originating from subgrid modeling assumptions in LES and RANS. Four different FGM databases
are compared for H2O, H2, CO, CO2 and OH predictions in Sandia Flames C to F. Species mass fractions will be compared to measurements directly and conditioned
on mixture fraction. Special attention is paid to the representation of experimentally observed differential diffusion effects
by FGM databases. 相似文献
4.
Philippe Franck Beáta Dajka-Halász Katrien Monsieurs Bert U.W. Maes 《Tetrahedron》2008,64(26):6030-6037
Pd-catalyzed cyclodehydrohalogenation involving oxidative addition of aromatic C-Br or activated azaheteroaromatic C-Cl bonds and C(sp2)-H activation have been investigated at high reaction temperatures (180-200 °C). This allowed the fast (10-30 min) synthesis of a variety of azaheteroaromatic ring systems (dibenzo[f,h]phthalazine, dibenzo[f,h]cinnoline, benzofuro[2,3-d]pyridazine, 5H-pyridazino[4,5-b]indole, 7H-indolo[2,3-c]quinoline and 5H-δ-carboline) in moderate to good yields. 相似文献
5.
Viviane Van Hoof Hugo Cluckers Vera Verhaeghe An Hennebel Marleen Truyens Edith Van Loock Pierre Rombouts Dirk Maes Jan Van Elven Katrien Lesage Mark Flothmann Lieve Nijs Filip Colpaert Werner Vercammen Dominique Bolain 《Accreditation and quality assurance》2004,10(1-2):55-59
In response to a change of the Belgian National Directives whereby hospital laboratories became responsible for all point-of-care testing (POCT) performed within hospital walls a standardized and automated POC glucose-testing system was implemented in our hospital. The system consists of 50 AccuCheck Inform instruments (Roche Diagnostics, Vilvoorde, Belgium), 50 docking stations, a DataCare Server, and connections to the medical laboratory information system (MOLIS, Sysmex, Barchon, Belgium) and to the hospital information system. Implementation involved many parties and extensive preparation and communication. Key issues were bar-coded patient and user identification, training, and responsibilities. One year after the hospital wide implementation of this system the quality of POC glucose testing has significantly increased, thereby improving patient safety. This study describes a stepwise change over involving the medical laboratory and with a focus on hands-on quality.Presented at the ninth conference on Quality in the Spotlight, 18–19 March 2004, Antwerp, Belgium. 相似文献
6.
Pál Tapolcsányi Bert U.W Maes Katrien MonsieursGuy L.F Lemière Zsuzsanna RiedlGyörgy Hajós Bart Van den DriesscheRoger A Dommisse Péter Mátyus 《Tetrahedron》2003,59(31):5919-5926
Palladium-catalyzed intramolecular arylation of 2-benzyl-5-(2-bromophenyl)-4-phenylpyridazin-3(2H)-one yielded hitherto unknown 2-benzyldibenzo[f,h]phthalazin-1(2H)-one. The synthesis of this new tetracyclic pyridazinone from 2-benzyl-5-(2-aminophenyl)-4-phenylpyridazin-3(2H)-one via a Pschorr type reaction was also investigated. Similarly, the construction of 2-methyldibenzo[f,h]cinnolin-3(2H)-one from 2-methyl-5-(2-bromophenyl)-6-phenylpyridazin-3(2H)-one and 2-methyl-5-(2-aminophenyl)-6-phenylpyridazin-3(2H)-one is also reported. Removal of the N-benzyl protective group of 2-benzyl-dibenzo[f,h]phthalazin-1(2H)-one with AlCl3 yielded unsubstituted dibenzo[f,h]phthalazin-1(2H)-one. 相似文献
7.
Herbert Struyf Luc Van Vaeck Katrien Poels René Van Grieken 《Journal of the American Society for Mass Spectrometry》1998,9(5):482-497
This study attempted to determine the molecular composition of inorganic analytes at the surface of solids by Fourier transform laser microprobe mass spectrometry (FT LMMS) with an external ion source. A database was established from the analysis of pure compounds. FT LMMS uses a similar ionization as the older LMMS instruments with time-of-flight (TOF) mass analyzer. However, apart from the mass resolution, the mass spectral patterns can be significantly different in FT LMMS compared to TOF LMMS. FT LMMS yields detailed information on the analyte by means of structural fragments, enabling us to specify the main building blocks, as well as adduct ions, consisting of the analyte molecule and a stable ion. Hence, deductive reasoning allows tentative characterization of the analogs without reference spectra, except for compounds with the same elements in different stoichiometries. In that case comparative data are needed. 相似文献
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