Search results for "double bond"

showing 10 items of 184 documents

Cycloadditionen von 2H ‐Benzo[ b ]thiet und Verbindungen mit kumulierten Doppelbindungen

1994

Cycloaddition Reactions of 2H-Benzo[b]thiete and Compounds with Cumulated Double Bonds o-Thiobenzoquinone methide (2), generated by thermal ring opening of 2H-benzo[b]thiete (1), reacts with allene 3, ketene imine 7, the carbodiimides 9a-c, and the N-sulfinylamines 11a-c in highly specific [8π + 2π] cycloaddition processes to form novel types of heterocyclic systems 4, 8, 10a-c, and 12a-c with exocyclic double bonds. The 1:1 adduct 4 can add a further molecule of allene to yield the spiro compounds 5 and 6.

Inorganic Chemistrychemistry.chemical_classificationchemistry.chemical_compoundDouble bondchemistryBicyclic moleculeStereochemistryAlleneImineKeteneRegioselectivityRing (chemistry)CycloadditionChemische Berichte
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ChemInform Abstract: Photochemical Transformations of Some Neoclerodane and Labdane Diterpene Ketones.

2010

Some neoclerodane (2–4) and labdane (5 and 6) diterpene ketones having a β- or γ-hydroxy function, an α-epoxy group, or an α-olefinic double bond have been irradiated at λ = 313 nm in dry solvents (benzene or methanol). Fruticolone (2) yielded the naturally occurring 5,6-seco-neoclerodan-6,1α-olide derivative fruticolide (1), while hispanolone (5) gave the δ-lactone 8, both transformations involving a Norrish type I photoreaction. The α,β-unsaturated ketone derivative 4 was transformed into 7 by a stereoselective intramolecular [2+2] cycloaddition reaction involving its furanic 13(16)-double bond. Finally, the α-epoxy ketone 6 was rearranged to the 10(98)abeo-labda-7,9-dione derivative 10. …

Labdanechemistry.chemical_classificationchemistry.chemical_compoundKetonechemistryDouble bondIntramolecular forceStereoselectivityGeneral MedicineDiterpenePhotochemistryCycloadditionDerivative (chemistry)ChemInform
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Conformational Properties of Oxazole-Amino Acids: Effect of the Intramolecular N–H···N Hydrogen Bond

2014

Oxazole ring occurs in numerous natural peptides, but conformational properties of the amino acid residue containing the oxazole ring in place of the C-terminal amide bond are poorly recognized. A series of model compounds constituted by the oxazole-amino acids occurring in nature, that is, oxazole-alanine (L-Ala-Ozl), oxazole-dehydroalanine (ΔAla-Ozl), and oxazole-dehydrobutyrine ((Z)-ΔAbu-Ozl), was investigated using theoretical calculations supported by FTIR and NMR spectra and single-crystal X-ray diffraction. It was found that the main feature of the studied oxazole-amino acids is the stable conformation β2 with the torsion angles φ and ψ of -150°, -10° for L-Ala-Ozl, -180°, 0° for ΔAl…

Magnetic Resonance SpectroscopyDouble bondNitrogenSurface PropertiesStereochemistryMolecular Conformation010402 general chemistry01 natural scienceschemistry.chemical_compoundSpectroscopy Fourier Transform InfraredMaterials ChemistryPeptide bondAmino AcidsPhysical and Theoretical ChemistryOxazolesOxazolechemistry.chemical_classificationAlanine010405 organic chemistryHydrogen bondAminobutyratesHydrogen BondingNuclear magnetic resonance spectroscopyModels Theoretical0104 chemical sciencesSurfaces Coatings and FilmsAmino acidNMR spectra databasechemistryIntramolecular forceSolventsThermodynamicsHydrogenThe Journal of Physical Chemistry B
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Muscarinic Properties of Compounds Related to Arecaidine Propargyl Ester

2011

A series of new analogues of the arecaidine propargyl ester (CAS 35516-99-5, APE, 1a) with alcohols consisting of 4 or 5 carbon atoms were investigated at muscarinic receptor subtypes. The muscarinic activity of the quaternary and tertiary salts of the APE-related compounds were assayed on the isolated guinea-pig ileum (M 3 receptor subtype) and guinea-pig left atria (M 2 receptor subtype) as well as on rabbit isolated vas deferens (M 1 receptor subtype). The structural variations made in the APE molecule, replacing the triple bond in the ester side chain with structures such as double bond, an allene moiety, a single bond, a cyclopropyl group or two triple bonds should alter the selectivit…

MaleDouble bondStereochemistryArecolineGuinea PigsCholinergic AgentsIn Vitro Techniqueschemistry.chemical_compoundVas DeferensIleumDrug DiscoveryMuscarinic acetylcholine receptorAnimalsMoietySingle bondReceptorReceptor Muscarinic M3chemistry.chemical_classificationReceptor Muscarinic M2Receptor Muscarinic M1HeartMuscle SmoothArecaidineTriple bondMyocardial ContractionReceptors MuscarinicchemistryPropargylFemaleRabbitsMuscle ContractionArzneimittelforschung
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Poly-l-Lactic Acid Nanofiber-Polyamidoamine Hydrogel Composites: Preparation, Properties, and Preliminary Evaluation as Scaffolds for Human Pluripote…

2016

Electrospun poly-l-lactic acid (PLLA) nanofiber mats carrying surface amine groups, previously introduced by nitrogen atmospheric pressure nonequilibrium plasma, are embedded into aqueous solutions of oligomeric acrylamide-end capped AGMA1, a biocompatible polyamidoamine with arg-gly-asp (RGD)-reminiscent repeating units. The resultant mixture is finally cured giving PLLA-AGMA1 hydrogel composites that absorb large amounts of water and, in the swollen state, are translucent, soft, and pliable, yet as strong as the parent PLLA mat. They do not split apart from each other when swollen in water and remain highly flexible and resistant, since the hydrogel portion is covalently grafted onto the …

Materials Chemistry2506 Metals and AlloysPluripotent Stem CellsAgmatinePolymers and PlasticsDouble bondpolyamidoaminesPolyestersCell Culture TechniquesNanofibersBioengineering02 engineering and technology010402 general chemistry01 natural sciencesBiomaterialsPolyamidoaminePolyaminesMaterials ChemistryHydrogel compositehuman pluripotent stem cellHumansatmospheric pressure nonequilibrium plasmaInduced pluripotent stem cellatmospheric pressure nonequilibrium plasma; electrospun poly-l-lactic nanofibers; human pluripotent stem cells; poly-l-lactic acid-AGMA1 hydrogel composites; polyamidoamines; biotechnology; bioengineering; biomaterials; polymers and plastics; materials chemistry2506 metals and aloyschemistry.chemical_classificationAddition reactionPolymers and PlasticAqueous solutionTissue ScaffoldsHydrogels021001 nanoscience & nanotechnologyBiomaterial0104 chemical sciencesChemical engineeringchemistryCovalent bondNanofiberelectrospun poly-l-lactic nanofiberpoly-l-lactic acid-AGMA1 hydrogel compositeAmine gas treating0210 nano-technologyBiotechnology
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Raman and nuclear magnetic resonance investigation of alkali metal vapor interaction with alkene-based anti-relaxation coating.

2016

The use of anti-relaxation coatings in alkali vapor cells yields substantial performance improvements by reducing the probability of spin relaxation in wall collisions by several orders of magnitude. Some of the most effective anti-relaxation coating materials are alpha-olefins, which (as in the case of more traditional paraffin coatings) must undergo a curing period after cell manufacturing in order to achieve the desired behavior. Until now, however, it has been unclear what physicochemical processes occur during cell curing, and how they may affect relevant cell properties. We present the results of nondestructive Raman-spectroscopy and magnetic-resonance investigations of the influence …

Materials scienceDouble bondphysics.chem-phFOS: Physical sciencesGeneral Physics and Astronomyengineering.material010402 general chemistry01 natural sciencessymbols.namesakeEngineeringCoatingPhysics - Chemical Physics0103 physical sciencesPhysical and Theoretical Chemistry010306 general physicsSpin relaxationCuring (chemistry)Chemical Physics (physics.chem-ph)chemistry.chemical_classificationPhysicochemical ProcessesCondensed Matter - Materials ScienceChemical PhysicsAlkeneMaterials Science (cond-mat.mtrl-sci)Alkali metalcond-mat.mtrl-sci0104 chemical sciences3. Good healthchemistryChemical engineeringPhysical SciencesChemical SciencessymbolsengineeringRaman spectroscopyBiotechnologyThe Journal of chemical physics
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Double bond-functionalized POSS: dispersion and crosslinking in polyethylene-based hybrid obtained by reactive processing

2016

Polyethylene-based organic inorganic hybrids were prepared by one-step reactive melt mixing using a mono-functionalized nanofiller, i.e., allyl-heptaisobutyl-substituted polyhedral oligomeric silsesquioxane (1POSS) and a multi-functionalized octavinyl polyhedral oligomeric silsesquioxane (8POSS). The hybrids were also prepared in dicumyl peroxide (DCP) presence and morphological, spectroscopical and calorimetric analysis were carried out. Moreover, rheological measurement and Sohxlet extraction were performed on investigated samples. It was inferred that double bonds of POSS functional groups were triggered by radicals coming from the peroxide decomposition or from the degradation reactions…

Materials sciencePolymers and PlasticsDouble bond02 engineering and technology010402 general chemistry01 natural sciencesPeroxidechemistry.chemical_compoundPolymer chemistryMaterials ChemistryMoleculeChemistry (all); Condensed Matter Physics; Polymers and Plastics; Materials Chemistry; 2506; Metals and AlloysMaterials Chemistry2506 Metals and Alloychemistry.chemical_classificationPolymers and PlasticChemistry (all)Metals and AlloysGeneral ChemistryPolyethylene021001 nanoscience & nanotechnologyCondensed Matter PhysicsSilsesquioxane0104 chemical sciencesPolyolefinchemistryCovalent bond25060210 nano-technologyDispersion (chemistry)Polymer Bulletin
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The role of molecular oxygen in the formation of radiation-engineered multifunctional nanogels

2019

Abstract Nanogels are very promising biomedical nanodevices. The classic “radiation chemistry-based” approach to synthetize nanogels consists in the irradiation with pulsed electron beams of dilute, N2O-saturated, aqueous solutions of water-soluble polymers of the “crosslinking type”. Nanogels with controlled size and properties are produced in a single irradiation step with no recourse to initiators, organic solvents and surfactants. This paper combines experimental syntheses, performed with two e-beam irradiation setups and dose-ranges, starting from poly(N-vinyl pyrrolidone) solutions of various concentrations, both in N2O-saturated and air-saturated initial conditions, with the numerica…

Materials sciencePolymers and PlasticsDouble bondKinetic modelingGeneral Physics and Astronomy02 engineering and technologyElectronRadiationRadiation chemistry010402 general chemistry01 natural sciencesNanogelMaterials ChemistryIrradiationchemistry.chemical_classificationAqueous solutionCrosslinkingOrganic ChemistryPolymer021001 nanoscience & nanotechnologyWater radiolysis0104 chemical sciencesChemical engineeringchemistryMechanism0210 nano-technologyNanogel
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Heterocyclic and Phenyl Double-Bond-Locked Combretastatin Analogues Possessing Potent Apoptosis-inducing activity in HL60 and in MDR Cell lines

2005

Two new series of combretastatin (CA-4) analogues have been prepared. The alkenyl motif of CA-4 was replaced either by a five-membered heterocyclic (isoxazoline or isoxazole) or by a six-membered ring (pyridine or benzene). The new compounds have been evaluated for their effects on tubulin assembly and for cytotoxic and apoptotic activities. Five compounds (18b, 20a, 21a, 34b, and 35b) demonstrated an attractive profile of cytotoxicity (IC501 microM) and apoptosis-inducing activity but poor antitubulin activity. The isoxazoline derivatives 18b, 20a, and 21a, demonstrated potent apoptotic activity different from that of natural CA-4. Their ability to block most cells in the G2 phase suggests…

Models MolecularA-4 ANALOGSDouble bondHL60StereochemistryPyridinesTUBULINApoptosisANTINEOPLASTIC AGENTSchemistry.chemical_compoundStructure-Activity RelationshipCell Line TumorDrug DiscoveryStilbenesBenzene DerivativesHumansIsoxazoleBIOLOGICAL EVALUATIONCytotoxicitychemistry.chemical_classificationCombretastatinbiologyCOLCHICINEDEATHIsoxazolesDrug Resistance MultipleTubulinANTIMITOTIC ANTITUMOR AGENTSMULTIDRUGchemistryApoptosisCell cultureDrug Resistance NeoplasmDISCOVERYbiology.proteinMolecular MedicineDrug Screening Assays AntitumorSOLID TUMOR-THERAPY
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DFT studies on the structural and vibrational properties of polyenes

2015

Detailed density functional theory (DFT) calculations on the structure and harmonic frequencies of model all-trans and all-cis polyenes were undertaken. For the first time, we report on the convergence of selected B3LYP/6-311++G** and BLYP/6-311++G** calculated structural parameters resulting from a systematic increase in polyene size (chains containing 2 to 14 C = C units). The limiting values of the structural parameters for very long chains were estimated using simple three-parameter empirical formulae. BLYP/6-311++G** calculated ν(C = C) and ν(C–C) frequencies for all-trans and all-cis polyenes containing up to 14 carbon–carbon double bonds were used to estimate these values for very lo…

Models MolecularDouble bondPolyenes02 engineering and technologyConjugated systemSpectrum Analysis RamanVibrationC-C bondAll-trans polyenesDFT01 natural sciencesMolecular physicsCatalysisInorganic ChemistryIR and Raman spectroscopychemistry.chemical_compoundComputational chemistry0103 physical sciencesWavenumberMoleculePhysical and Theoretical Chemistrychemistry.chemical_classificationOriginal Paper010304 chemical physicsChemistryOrganic ChemistryLimitingEthylenes021001 nanoscience & nanotechnologyPolyeneComputer Science ApplicationsC = C bondComputational Theory and MathematicsQuantum TheoryDensity functional theoryAll-cis polyenes0210 nano-technologyJournal of Molecular Modeling
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