Search results for "Schmidt reaction"

showing 2 items of 2 documents

A theoretical and experimental study of the formation mechanism of 4-X-chalcones by the Claisen–Schmidt reaction

2000

Abstract A theoretical and experimental study on the formation of 4-X-chalcones (X=H, Cl, F, OCH3, N(CH3)2) was carried out by the Claisen–Schmidt reaction. The influence of pH and temperature was analyzed. Under the adopted experimental conditions 4-X-chalcones were the only reaction products. In the theoretical study, the thermodynamic magnitudes and the reactivity indexes calculated with the AM1 method were used. The mechanism of Nayak and Rout was analyzed critically and a new mechanism was proposed, characterized by: (1) rapid nucleophilic attack of the catalyst (OH−) on the carbon atom of the methyl group of acetophenone; (2) attacks of the acetophenonate ion on the carbon atom of the…

ChemistryCondensed Matter PhysicsBiochemistryReaction rateElimination reactionchemistry.chemical_compoundReaction rate constantNucleophileComputational chemistrySchmidt reactionReactivity (chemistry)Physical and Theoretical ChemistryEquilibrium constantMethyl groupJournal of Molecular Structure: THEOCHEM
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Crystal structure of the chalcone (E)-3-(furan-2-yl)-1-phenylprop-2-en-1-one

2015

The crystal packing of the compound is described by an inter­molecular arrangement with the mol­ecules as inter­laced layers in a zigzag fashion, denoting inter­acting self-complementary dimers mainly by the localization of weak hydrogen bonds in a head-to-tail arrangement.

chemistry.chemical_classificationChalconecrystal structureCrystallographyDouble bondHydrogen bondChemistryStereochemistryClaisen–Schmidt reactionbiological activityGeneral ChemistryCrystal structureCondensed Matter PhysicsRing (chemistry)hydrogen bondingAcceptorResearch CommunicationsCrystalchemistry.chemical_compoundCrystallographychalcone derivativezigzag fashion.QD901-999FuranGeneral Materials ScienceActa Crystallographica Section E: Crystallographic Communications
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