Search results for "Butene"

showing 10 items of 26 documents

CCDC 197176: Experimental Crystal Structure Determination

2004

Related Article: M.L.Calatayud, J.Sletten, I.Castro, M.Julve, G.Seitz, K.Mann|2003|Inorg.Chim.Acta|353|159|doi:10.1016/S0020-1693(03)00221-4

(34-dimercapto-3-cyclobutene-12-dione)-bis(110-phenanthroline)-nickel(ii) hydrateSpace GroupCrystallographyCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
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Benzoxetes and Benzothietes ¾ Heterocyclic Analogues of Benzocyclobutene

2012

Benzo-condensed four-ring heterocycles, such as benzoxetes 1 and benzothietes 3 represent multi-purpose starting compounds for the preparation of various higher heterocyclic ring systems. The thermal or photochemical valence isomerizations between the benzenoid forms 1,3 and the higher reactive o-quinoid structures 2,4 provide the basis for the synthetic applications. On the other hand, this valence isomerization impedes in particular the generation and storage of 1 because the thermal equilibrium 1 ⇆ 2 is completely on the side of 2. Thus, the number of erroneous or questionable benzoxete structures published to date is surprisingly high. On the contrary, the thermal equilibrium 3 ⇆ 4 is o…

Double bondflash-vacuum-pyrolysisPharmaceutical ScienceReviewring closureAnalytical Chemistrylcsh:QD241-441chemistry.chemical_compoundlcsh:Organic chemistryBenzocyclobuteneComputational chemistryHeterocyclic CompoundsDrug DiscoveryOrganic chemistryPolycyclic CompoundsPhysical and Theoretical Chemistryring openingcycloadditionchemistry.chemical_classificationThermal equilibriumValence (chemistry)photochemistryFlash vacuum pyrolysisOrganic ChemistryCycloadditionchemistryChemistry (miscellaneous)Molecular MedicineIsomerizationMolecules
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The electronic substituent influence on the thermally allowed electrocyclic interconversion cyclobutene/butadiene. A MNDO study

1984

The effects of donor/acceptor substitution on the conrotatory cyclobutene/butadiene interconversion have not yet been experimentally studied. MNDO Synchronous Transit/MINIMAX calculations for all possible combinations of NH2/NH3 + 3 groups at the fissile single bond reveal very large substituent effects on the opening reactions and reverse cyclisations. Diamino(1b/2b), diammonio-(1c/2c) and amino-ammonio-substitutions (1d/2d) change the activation energy of the reference ring opening reaction (1a →2a) from 49.9 kcal/mol to 34.7, 29.8 and 26.0 kcal/mol, respectively. This rate enhancement parallels the monotone shift of the transition state pathcoordinate towards the cyclobutenes. Relative t…

Hammond's postulateElectrocyclic reactionCyclobuteneSubstituentMNDOPhotochemistrychemistry.chemical_compoundchemistryComputational chemistryElectronic effectSingle bondChiropracticsPhysical and Theoretical ChemistryConrotatory and disrotatoryTheoretica Chimica Acta
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C,N-chelated dicyclopentadienylzirconium complexes and their possible use as hydrogenation catalysts

2010

Abstract In situ generated Cp2Zr(n-Bu)Cl (6) reacts with {2-[(CH3)2NCH2]C6H4}2Pb to form exclusively {2-[(CH3)2NCH2]C6H4}Cp2ZrCl (7), [(CH3)2NCH2]C6H5, butene and elemental lead. The further derivatization of chloride (7) to fluoride (8), hydride (9), methyl derivative (10), and a reduction of 7 are also described. The crystal structures of 7–10 were determined. The catalytic activity of 9 and 10 in hydrogenation of styrene was also preliminarily tested.

HydrideInorganic chemistryCrystal structureMedicinal chemistryChlorideButeneCatalysisStyreneInorganic Chemistrychemistry.chemical_compoundTransmetalationchemistryMaterials ChemistrymedicinePhysical and Theoretical ChemistryDerivatizationmedicine.drugInorganic Chemistry Communications
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DFT studies on catalytic properties of isolated and carbon nanotube supported Pd9 cluster. Part II. Hydro-isomerization of butene isomers

2010

The processes involved in the butene hydro-isomerization, occurring on a small palladium cluster in the presence of dissociated hydrogen, have been investigated by means of DFT and DFT/MM approaches. This study has been performed both on an isolated (unsupported) Pd(9) cluster and on the same cluster when it is supported on a portion of a single-walled armchair(6,6) carbon nanotube. The study follows another investigation which has already been published concerning the adsorption, fragmentation and diffusion of hydrogen on the same metal cluster. The main aspects involved in the parallel reaction steps of the whole hydro-isomerization mechanisms are not strongly affected by the presence of …

HydrogenSupported metal clusters hydrogenationGeneral Physics and Astronomychemistry.chemical_elementHydrogen atomButeneCatalysischemistry.chemical_compoundAdsorptionchemistryComputational chemistryCluster (physics)Physical and Theoretical ChemistryIsomerizationPalladium
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Selective Oxidation of n-Butane and Butenes over Vanadium-Containing Catalysts

2000

Abstract The oxidative dehydrogenation (OXDH) of n-butane, 1-butene, and trans-2-butene on different vanadia catalysts has been compared. MgO, alumina, and Mg–Al mixed oxides with Mg/(Al+Mg) ratios of 0.25 and 0.75 were used as supports. The catalytic data indicate that the higher the acid character of catalysts the lower is both the selectivity to C4-olefins from n-butane and the selectivity to butadiene from both 1-butene or trans-2-butene. Thus, OXDH reactions are mainly observed from n-butane and butenes on basic catalysts. The different catalytic performance of both types of catalysts is a consequence of the isomerization of olefins on acid sites, which appears to be a competitive reac…

Inorganic chemistryVanadiumchemistry.chemical_elementHeterogeneous catalysisButeneRedoxCatalysisVanadium oxideCatalysischemistry.chemical_compoundchemistryAlkoxideDehydrogenationPhysical and Theoretical Chemistry
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Cleavable Polyethylene Glycol: 3,4-Epoxy-1-butene as a Comonomer to Establish Degradability at Physiologically Relevant pH.

2016

Polyethylene glycol (PEG) has been used for decades to improve the pharmacokinetic properties of protein drugs, and several PEG-protein conjugates are approved by the FDA. However, the nondegradability of PEG restricts its use to a limiting molecular weight to permit renal excretion. In this work, we introduce a simple strategy to overcome the nondegradability of PEG by incorporating multiple pH-sensitive vinyl ether moieties into the polyether backbone. Copolymerization of 3,4-epoxy-1-butene (EPB) with ethylene oxide via anionic ring-opening polymerization (AROP) provides access to allyl moieties that can be isomerized to pH-cleavable propenyl units (isoEPB). Well-defined P(EPB-co-EG) copo…

Materials sciencePolymers and Plasticsmacromolecular substances02 engineering and technologyPolyethylene glycol010402 general chemistry01 natural sciencesInorganic Chemistrychemistry.chemical_compoundPEG ratioPolymer chemistryMaterials ChemistrymedicineOrganic chemistryPropenylEthylene oxideComonomerOrganic Chemistrytechnology industry and agriculture1-ButeneVinyl ether021001 nanoscience & nanotechnology0104 chemical scienceschemistryPolymerization0210 nano-technologymedicine.drugACS macro letters
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On the photoreaction of some 1,2,4-oxadiazoles in the presence of2,3-dimethyl-2-butene. Synthesis of N-imidoyl-aziridines

2007

Fhe photochemistry of some 3,5-disubstituted 1,2,4-oxadiazoles in the presence of 2,3-dimethyl-2-butene has been investigated. The irradiation in acetonitrile yielded differently substituted N-imidoyl-aziridines through an aziridination reaction involving an acyliminonitrene intermediate. Pyrolysis of N-imidoyl-aziridines produced the corresponding N-allylamidines through a ring opening process.

PharmacologyphotochemistryOrganic Chemistry124-oxadiazoleGeneral MedicineRing (chemistry)Photochemistrypyrolysi2-ButeneAnalytical Chemistrychemistry.chemical_compoundN-allylamidinechemistryScientific methodOrganic chemistryIrradiationAcetonitrilePyrolysisN-imidoylaziridine
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Thermal stability of poly(styrene-b-methyl methacrylate) and poly(styrene-b-ethylene-co-1-butene-b-methyl methacrylate)

1993

The thermal stability of poly(styrene-b-methyl methacrylate) diblock copolymers (= P(S-b-MMA)) and poly(styrene-b-ethylene-co-1-butene-b-methyl methacrylate) triblock copolymers (=P(S-b-EB-b-MMA)) was investigated. Well-defined high molecular weight block copolymers with narrow molecular weight distribution (MWD) were molded at different temperatures in vacuum and the alteration of the MWD was sensitively monitored by gel permeation chromatography (GPC). Up to 240°C P(S-b-MMA) shows almost no broadening of the MWD. At higher temperatures low molecular weight polystyrene-rich portions are formed. The number average molecular weight (Mn) is strongly reduced. P(S-b-EB-b-MMA) triblock copolymer…

Polymers and PlasticsChemistry1-ButeneGeneral ChemistryCondensed Matter PhysicsMethacrylateStyreneGel permeation chromatographychemistry.chemical_compoundPolymer chemistryMaterials ChemistryCopolymerMolar mass distributionThermal stabilityMethyl methacrylatePolymer Bulletin
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Mesophase formation in poly(propylene-ran-1-butene) by rapid cooling

2009

Abstract The effect of random insertion of low amount of 1-butene of less than about 11 mol% into the isotactic polypropylene chain on structure formation at non-isothermal crystallization at different rate of cooling was investigated by X-ray scattering, density measurements, and atomic force and polarizing optical microscopy. Emphasis is put on the evaluation of the condition of crystallization for replacement of lamellar crystals by mesomorphic nodules on increasing the cooling rate/supercooling. In the polypropylene homopolymer, mesophase formation occurs on cooling at rates larger about 150–200 K s −1 , while in case of poly(propylene- ran -1-butene) mesophase formation is observed on …

PolypropyleneMaterials sciencePolymers and PlasticsOrganic ChemistryMesophase1-Butenelaw.inventionchemistry.chemical_compoundSettore ING-IND/22 - Scienza E Tecnologia Dei MaterialichemistryChemical engineeringlawTacticityPolymer chemistryMaterials ChemistryOrthorhombic crystal systemIsotactic polypropylene Poly(propylene-ran-1-butene) CrystallizationCrystallizationSupercoolingMonoclinic crystal system
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