Search results for "Benzene"

showing 10 items of 1701 documents

Mononuclear heterocyclic rearrangement. Part 6 . Studies on base catalysis of the rearrangement of the (Z)-p-nitrophenylhydrazone of 3-benzoyl-5-phen…

1981

chemistry.chemical_compoundchemistryStereochemistryKornblum–DeLaMare rearrangementOrganic ChemistryOxadiazolePiperidineSigmatropic reactionBenzeneMedicinal chemistryTriethylamineCarroll rearrangementCatalysisJournal of Heterocyclic Chemistry
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Gekreuzt konjugierte oligomere aus pyrrol-, benzol- und carbonyl-Bausteinen

2004

Abstract Chalcones can serve as C 2 or C 3 components for the formation of 1 H -pyrroles. In particular the reaction with tosylisocyanid could be applied to the oligochalcones 2d - g with up to 6 enone units. A series of cross-conjugated oligomers 8d - g was obtained; these compounds consist of a chain of 1,4-phenylene, carbonyl and 1 H -pyrrole-3,4-diyl building blocks. The benzene rings bear two propoxy sidechains in order to enhance the solubility.

chemistry.chemical_compoundchemistryStereochemistryOrganic ChemistryDrug DiscoveryCross-conjugationSolubilityBenzeneBiochemistryEnoneTetrahedron
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A combined experimental and theoretical study of the alkylation of 3,5-dithioxo-[1,2,4]triazepines

2008

The chemo- and regioselective alkylation reactions of 3,5-dithioxo[1,2,4]triazepine 1 in a basic medium with α,ω-dibromoalkanes 2a–c, Br(CH2)nBr (n = 1–3), are studied experimentally and theoretically. These alkylations, which occur at the thioxo sulfur atom in position 5, afford mainly 5-bromomethylthio-2,7-dimethyl- 2,3-dihydro- 4H[1,2,4]triazepin-3-one 3 for n = 1, 6,8-dimethyl-5-thioxo-2,3,4,5-tetrahydro-6H[1,3]thiazolo[4,5-d][1,2,4]triazepine 4 for n = 2 and 7,9-dimethyl-6-thioxo-2,3,4,5,6,7-hexahydro[1,3]thiazino [4,5-d][1,2,4]triazepine 5 for n = 3. Theoretical calculations have been carried out at the B3LYP/6-31G* and B3LYP(benzene)/6-311+G*//B3LYP/6-31G* levels, in order to rationa…

chemistry.chemical_compoundchemistryStereochemistryOrganic ChemistrySN2 reactionRegioselectivityPhysical and Theoretical ChemistryAlkylationBenzeneJournal of Physical Organic Chemistry
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Cytoprotective effects of the antioxidant phytochemical indicaxanthin in beta-thalassemia red blood cells

2006

Antioxidant phytochemicals are investigated as novel treatments for supportive therapy in beta-thalassemia. The dietary indicaxanthin was assessed for its protective effects on human beta-thalassemic RBCs submitted in vitro to oxidative haemolysis by cumene hydroperoxide. Indicaxanthin at 1.0-10 microM enhanced the resistance to haemolysis dose-dependently. In addition, it prevented lipid and haemoglobin (Hb) oxidation, and retarded vitamin E and GSH depletion. After ex vivo spiking of blood from thalassemia patients with indicaxanthin, the phytochemical was recovered in the soluble cell compartment of the RBCs. A spectrophotometric study showed that indicaxanthin can reduce perferryl-Hb ge…

congenital hereditary and neonatal diseases and abnormalitiesAntioxidantErythrocytesPyridinesmedicine.medical_treatmentindicaxanthinphytochemicalBiochemistryHemolysisAntioxidantschemistry.chemical_compoundHemoglobinsAntioxidants betalainhemic and lymphatic diseasesSettore BIO/10 - BiochimicamedicineBenzene DerivativesHumansVitamin ETraditional medicineDose-Response Relationship DrugChemistrybeta-ThalassemiaBeta thalassemiaGeneral Medicinemedicine.diseaseLipid MetabolismGlutathionehaemoglobinBetaxanthinsPhytochemicalBiochemistryCytoprotectionSpectrophotometryCase-Control StudiesHeminAntioxidants betalains haemoglobin indicaxanthin phytochemicals red blood cellsIndicaxanthinOxidation-Reductionred blood cells
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Naphthalene-2,6-diyl bis(4-methylbenzenesulfonate)

2018

The complete molecule of the title compound, C24H20O6S2, is generated by a crystallographic inversion centre at the middle of the naphthalene ring system. The dihedral angle between the naphthalene ring system and the pendant benzene ring is 10.23 (6)° and the C—S—O—C torsion angle is −172.05 (10)°. In the crystal, weak C—H...O interactions link the molecules into (10-1) sheets.

crystal structure010405 organic chemistryChemistryGeneral MedicineCrystal structureDihedral angle010402 general chemistryRing (chemistry)01 natural sciencesCoupling reactioncrosscoupling reactions0104 chemical sciencesCrystalCrystallographychemistry.chemical_compoundSulfonatecross-coupling reactionslcsh:QD901-999lcsh:CrystallographyPhysics::Chemical PhysicsBenzenetosylatesNaphthaleneIUCrData
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4-Chloronaphthalen-1-yl 4-methylbenzenesulfonate

2018

In the title compound, C17H13ClO3S, the naphthalene ring system and the benzene ring of the tosylate substituent are inclined to one another by 55.32 (5)°. The crystal structure features weak intermolecular C—H...O hydrogen bonds, one of which forms inversion dimers. Additional C—H...O hydrogen bonds and weak Cl...Cl halogen bonds stack the molecules along the b-axis direction.

crystal structure010405 organic chemistryChemistryHydrogen bondSubstituentGeneral MedicineCrystal structure010402 general chemistryRing (chemistry)01 natural sciencesMedicinal chemistryCoupling reactioncrosscoupling reactions0104 chemical scienceschemistry.chemical_compoundSulfonatecross-coupling reactionsHalogenlcsh:QD901-999lcsh:CrystallographyPhysics::Chemical PhysicsBenzenetosylatesIUCrData
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3,5-Bis(trifluoromethyl)phenyl 4-methylbenzenesulfonate

2017

Molecules of the title compound, C15H10F6O3S, are composed of 3,5-bis(trifluoromethyl)phenyl substituted with a toluene-4-sulfonate group. The dihedral angle between two aromatic moieties is 45.10 (5)°. In the crystal, molecules are connected by weak C—H...O and C—H...F contacts. One of the trifluoromethyl groups is disordered.

crystal structure010405 organic chemistryMeth-Crystal structuretosyl­atesDihedral angle010402 general chemistry01 natural sciencesCoupling reaction0104 chemical sciencesCrystalchemistry.chemical_compoundSulfonatecross-coupling reactionschemistryGroup (periodic table)Polymer chemistryMethyl benzeneIUCrData
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Crystal structure of 2-{[1-(2-methyl-5-nitro-1H-imidazol-1-yl)propan-2-yloxy]carbonyl}benzoic acid

2014

In the title compound, C15H15N3O6, the dihedral angle between the planes of the benzene and imidazole rings is 34.93 (10)°. An intramolecular C—H...O hydrogen bond is observed. In the crystal, O—H...N hydrogen bonds link the molecules into chains parallel to thecaxis.

crystal structureCrystal structurepharmaceuticalsDihedral angleBioinformaticsMedicinal chemistrynitro­imidazolesCrystalchemistry.chemical_compoundImidazoleGeneral Materials SciencePhysics::Chemical PhysicsO—H⋯N hydrogen bondsBenzeneBenzoic acidQuantitative Biology::BiomoleculesnitroimidazolesCrystallographyHydrogen bondGeneral ChemistryCondensed Matter PhysicsData ReportsO—H...N hydrogen bondschemistryQD901-999NitroActa Crystallographica Section E Structure Reports Online
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Crystal structure of 5-(4-tert-butoxyphenyl)-3-(4-n-octyloxyphenyl)-4,5-dihydroisoxazole

2019

The molecule of the title compound, C27H37NO3, was prepared by [3 + 2] 1,3-dipolar cycloaddition of 4-n-octylphenylnitrile oxide and 4-tert-butoxystyrene, the latter compound being a very useful intermediate to the synthesis of liquid-crystalline materials. In the molecule, the benzene rings of the n-octyloxyphenyl and tert-butoxyphenyl groups form dihedral angles of 2.83 (7) and 85.49 (3)°, respectively, with the mean plane of the isoxazoline ring. In the crystal, molecules are linked by weak C—H...O hydrogen interactions into chains running parallel to the b axis.

crystal structureCrystallographyOxideGeneral ChemistryCrystal structureisoxazolinesDihedral angleCondensed Matter PhysicsRing (chemistry)Medicinal chemistrysingle crystalsCrystalchemistry.chemical_compoundliquid crystalschemistryLiquid crystalQD901-999General Materials ScienceIsoxazoleBenzene[3 + 2] cycloadditionActa Crystallographica Section E: Crystallographic Communications
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Crystal structure of 2-(adamantan-1-yl)-5-(4-bromophenyl)-1,3,4-oxadiazole

2014

In the title molecule, C18H19BrN2O, the benzene ring is inclined to the oxadiazole ring by 10.44 (8)°. In the crystal, C—H...π interactions link the molecules in a head-to-tail fashion, forming chains extending along thec-axis direction. The chains are further connected by π–π stacking interactions, with centroid–centroid distances of 3.6385 (7) Å, forming layers parallel to thebcplane.

crystal structureCrystallographyStackingπ–π inter­actionsGeneral ChemistryCrystal structureCondensed Matter PhysicsBioinformaticsRing (chemistry)adamntane derivativeData ReportsCrystalchemistry.chemical_compoundCrystallographyC—H...π hydrogen bonds134-oxa­diazoleC—H⋯π hydrogen bondschemistryQD901-999π–π interactions134-oxadiazoleDiazoleGeneral Materials ScienceBenzeneActa Crystallographica Section E
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