Search results for "Derivative"

showing 10 items of 1074 documents

One-pot synthesis of fluorinated 2-amino-pyrimidine-N-oxides. Competing pathways in the four-atom side-chain rearrangements of 1,2,4-oxadiazoles

2006

Abstract Trifluoromethylated 2-amino-pyrimidine N-oxides have been synthesized by reaction of the 3-amino-5-methyl-1,2,4-oxadiazole with trifluoromethyl-β-diketones in the presence of perchloric acid, followed by hydrolysis. In this ring-to-ring transformation an initial formation of (unisolated) 1,2,4-oxadiazole-pyrimidinium salts, and subsequent ring-opening at the oxadiazole moiety occurs. Isolation of 2-(hydroxyamino)-pyrimidine from the reaction mixture evidenced the presence of a competing pathway where the N(4) nitrogen of the oxadiazole is involved in the formation of a regioisomeric pyrimidinium salt. The effect of the trifluoromethyl group on the product distribution is discussed.…

fluoropyrimidine derivativecrystal structurepyrimidine N-oxidePyrimidinesynthesisStereochemistryOne-pot synthesisOxadiazoleX ray analysis3 diketoneBiochemistryMedicinal chemistryperchloric acidnitrogenchemistry.chemical_compoundside-chain rearrangementDrug DiscoveryStructural isomerSide chainMoietyPerchloric acidring openingfluorinated heterocycle3 diketone fluoropyrimidine derivative ketone derivative nitrogen oxide perchloric acid; article crystal structure hydrolysis priority journal reaction analysis ring opening synthesis X ray analysisTrifluoromethylChemistryOrganic Chemistryarticle124-oxadiazoleketone derivativereaction analysishydrolysispriority journaloxide
researchProduct

Tangents to fractal curves and surfaces

2010

International audience; The aim of our work is to specify and develop a geometric modeler, based on the formalism of iterated function systems with the following objectives: access to a new universe of original, various, aesthetic shapes, modeling of conventional shapes (smooth surfaces, solids) and unconventional shapes (rough surfaces, porous solids) by defining and controlling the relief (surface state) and lacunarity (size and distribution of holes). In this context we intend to develop differential calculus tools for fractal curves and surfaces defined by IFS. Using local fractional derivatives, we show that, even if most fractal curves are nowhere differentiable, they admit a left and…

fractal curve[INFO.INFO-GR] Computer Science [cs]/Graphics [cs.GR]local fractional derivativeiterated function systems[ INFO.INFO-GR ] Computer Science [cs]/Graphics [cs.GR][INFO.INFO-GR]Computer Science [cs]/Graphics [cs.GR]fractal surface
researchProduct

Tuning the Electrochemistry of Free-Base Porphyrins in Acidic Nonaqueous Media: Influence of Solvent, Supporting Electrolyte, and Ring Substituents

2016

International audience; A detailed study of reduction potentials, electroreduction mechanisms and acid-base chemistry was carried out on two series of free-base porphyrins in nonaqueous media. The first series is represented by four-pyrrole substituted tetraphenylporphyrin (TPP) derivatives, two of which are planar and two of which are nonplanar in their non-protonated form. The second comprises porphyrins with 0-4 meso-phenyl groups on the macrocycle. Equilibrium constants for conversion of each neutral porphyrin to its diprotic [H4P] 2+ form were determined and the electrochemistry was then elucidated as a function of: (i) type of nonaqueous solvent, (ii) anion of supporting electrolyte, …

free-base porphyrinsSupporting electrolyteprotonationInorganic chemistry010402 general chemistryElectrochemistry[ CHIM ] Chemical Sciences01 natural sciencesCatalysistetraphenylporphyrin monoacidschemistry.chemical_compoundconformational-analysismetal derivativesTetraphenylporphyrin[CHIM]Chemical SciencesReactivity (chemistry)tetraarylporphyrinsEquilibrium constantcomplexes010405 organic chemistryFree basecrystal-structurespectroelectrochemistryanionDiprotic acidPorphyrin0104 chemical sciencessupporting electrolytechemistryelectrochemistryexpanded porphyrindiacids[CHIM.OTHE]Chemical Sciences/Otherabsorption
researchProduct

Evolutionary game theory of continuous traits from a causal perspective

2023

Modern evolutionary game theory typically deals with the evolution of continuous, quantitative traits under weak selection, allowing the incorporation of rich biological detail and complicated nonlinear interactions. While these models are commonly used to find candidates for evolutionary endpoints and to approximate evolutionary trajectories, a less appreciated property is their potential to expose and clarify the causal structure of evolutionary processes. The mathematical step of differentiation breaks a nonlinear model into additive components which are more intuitive to interpret, and when combined with a proper causal hypothesis, partial derivatives in such models have a causal meanin…

game theorycausalitycausal graphpath coefficientevolutionkausaliteettievoluutiopeliteoriaGeneral Agricultural and Biological Sciencescausal derivativeGeneral Biochemistry Genetics and Molecular BiologyPhilosophical Transactions of the Royal Society B: Biological Sciences
researchProduct

On Descriptive Characterizations of an Integral Recovering a Function from Its $$L^r$$-Derivative

2022

The notion of Lr-variational measure generated by a function F ∈ Lr[a, b] is introduced and, in terms of absolute continuity of this measure, a descriptive characterization of the HKr -integral recovering a function from its Lr-derivative is given. It is shown that the class of functions generating absolutely continuous Lr-variational measure coincides with the class of ACGr -functions which was introduced earlier, and that both classes coincide with the class of the indefinite HKr-integrals under the assumption of Lr-differentiability almost everywhere of the functions consisting these classes

generalized absolute continuity of a functionHenstock–Kurzweil-type integralabsolutely continuous measureSettore MAT/05 - Analisi MatematicaGeneral MathematicsLr-derivativeLr-variational measure
researchProduct

Investigation of photoluminescence and amplified spontaneous emission properties of cyanoacetic acid derivative (KTB) in PVK amorphous thin films

2018

This work was supported by European Regional Development Fund within the Project No. 1.1.1.1/16/A/046 and A.Riekstins SIA “Mikrotīkls” donation, administered by University of Latvia Foundation.

guest-host systemAmplified spontaneous emissionQuenching (fluorescence)Materials sciencePhotoluminescenceDye lasercyanoacetic acid derivativeQuantum yieldglass forming low molecular weight compounds02 engineering and technology010402 general chemistry021001 nanoscience & nanotechnologyPhotochemistryThreshold energy7. Clean energy01 natural sciences0104 chemical sciencesAmorphous solidamplified spontaneous emission:NATURAL SCIENCES:Physics [Research Subject Categories]0210 nano-technologyLuminescencelaser dyesOrganic Electronics and Photonics: Fundamentals and Devices
researchProduct

Self-Assembled Molecular Rafts at Liquid|Liquid Interfaces for Four-Electron Oxygen Reduction

2011

The self-assembly of the oppositely charged water-soluble porphyrins, cobalt tetramethylpyridinium porphyrin (CoTMPyP(4+)) and cobalt tetrasulphonatophenyl porphyrin (CoTPPS(4-)), at the interface with an organic solvent to form molecular "rafts", provides an excellent catalyst to perform the interfacial four-electron reduction of oxygen by lipophilic electron donors such as tetrathiafulvalene (TTF). The catalytic activity and selectivity of the self-assembled catalyst toward the four-electron pathway was found to be as good as that of the Pacman type cofacial cobalt porphyrins. The assembly has been characterized by UV-visible spectroscopy, Surface Second Harmonic Generation, and Scanning …

inorganic chemicals2Nd-Harmonic Generationchemistry.chemical_elementPhotochemistryBiochemistryOxygenCatalysisCatalysischemistry.chemical_compoundWater-Soluble PorphyrinsColloid and Surface ChemistryCobalt Porphyrinsheterocyclic compoundsLiquid/Liquid Interface2Nd DerivativesEnergyDioxygenPolarizable Continuum ModelGeneral ChemistryPorphyrinRadical CationchemistryRadical ionSurface second harmonic generationDensity functional theoryImmiscible Electrolyte-SolutionsCobaltTetrathiafulvalene
researchProduct

A solvent-free regioselective iodination route of ortho-carboranes.

2006

Tetraiodo-ortho-carborane based X-ray contrast agents can be readily prepared in a high yield, fast, clean, regioselective fashion by a solvent-free reaction of ortho-carboranes with iodine in sealed tubes.

inorganic chemicalsBoron Compoundschemistry.chemical_elementContrast MediaOrganic-reactions010402 general chemistryIodine01 natural sciencesChemical synthesisInorganic ChemistryQUIMICA ANALITICAOrganic chemistryheterocyclic compoundsSolvent freeintegumentary system010405 organic chemistryChemistryorganic chemicalsRegioselectivityHalogenationCombinatorial chemistry0104 chemical sciencesRadiographyChemical-synthesisOrganic reactionYield (chemistry)SolventsbacteriaDerivativesIodineDalton transactions (Cambridge, England : 2003)
researchProduct

A new simple chromo-fluorogenic probe for NO2 detection in air.

2015

[EN] A new chromo-fluorogenic probe, consisting of a biphenyl derivative containing both a silylbenzyl ether and a N,N-dimethylamino group, for NO2 detection in the gas phase has been developed. A clear colour change from colourless to yellow together with an emission quenching was observed when the probe reacted with NO2. A limit of detection to the naked eye of about 0.1 ppm was determined and the system was successfully applied to the detection of NO2 in realistic atmospheric conditions.

inorganic chemicalsGas phase reactionsAnalytical chemistryEtherPhotochemistryNO2Nitric Oxidecomplex mixturesCatalysisGas phasechemistry.chemical_compoundQUIMICA ORGANICAChromogenic detectionFluorescent DyesDetection limitBiphenylEmission quenchingSIMPLE (dark matter experiment)Molecular StructureSensorsAirOrganic ChemistryQUIMICA INORGANICAGeneral Chemistryrespiratory systemchemistryChromogenic CompoundsNaked eyeDerivative (chemistry)Chemistry (Weinheim an der Bergstrasse, Germany)
researchProduct

Synthesis, Characterization, and Cu(2+) Coordination Studies of a 3-Hydroxy-4-pyridinone Aza Scorpiand Derivative.

2016

The synthesis, acid-base behavior, and Cu(2+) coordination chemistry of a new ligand (L1) consisting of an azamacrocyclic core appended with a lateral chain containing a 3-hydroxy-2-methyl-4(1H)-pyridinone group have been studied by potentiometry, cyclic voltammetry, and NMR and UV-vis spectroscopy. UV-vis and NMR studies showed that phenolate group was protonated at the highest pH values [log K = 9.72(1)]. Potentiometric studies point out the formation of Cu(2+) complexes of 1:2, 2:2, 4:3, 1:1, and 2:1 Cu(2+)/L1 stoichiometries. UV-vis analysis and electrochemical studies evidence the implication of the pyridinone moieties in the metal coordination of the 1:2 Cu(2+)/L1 complexes. L1 shows …

inorganic chemicalsMagnetic Resonance SpectroscopyStereochemistryPyridinesPyridonesPotentiometric titrationProtonationChemistry Techniques Synthetic010402 general chemistry010403 inorganic & nuclear chemistryElectrochemistryCrystallography X-Ray01 natural sciencesMedicinal chemistryAntioxidantsCoordination complexInorganic Chemistrychemistry.chemical_compoundStructure-Activity RelationshipCoordination ComplexesHumansChelationPhysical and Theoretical ChemistryCell ProliferationChelating Agentschemistry.chemical_classificationLigandHydrogen-Ion Concentration0104 chemical scienceschemistryPotentiometrySpectrophotometry UltravioletCyclic voltammetryDerivative (chemistry)CopperHeLa CellsInorganic chemistry
researchProduct