Awesome Chemistry Experiments For C9H9BrO2

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1-Alkoxycarbonyl-3-halogenoazetidin-2-ones as elastase (PPE) inhibitors

A series of 1-alkoxycarbonyl-3-halogenoazetidin-2-ones, designed as potential suicide inhibitors of serine proteases, has been synthesized and evaluated against porcine pancreatic elastase (PPE). All the compounds were transient inhibitors, their activity depending mainly on the nature of the halogen substituent: bromo- and iodo- derivatives are more active (Ki ?2-22 muM) than 3-chloroazetidinones (Ki ?20-150 muM). The lipophilicity of the N-1 substituent appeared to exert a slightly positive effect.

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Reference:
Benzodioxan,
1,4-Benzodioxane | C8H8O2 – PubChem

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Chemo-enzymatic cascade processes are invaluable due to their ability to rapidly construct high-value products from available feedstock chemicals in a one-pot relay manner.In a patent, 214894-89-0, name is 5-(Bromomethyl)-2,3-dihydro-1,4-benzodioxine, introducing its new discovery. Formula: C9H9BrO2

CuBr2 catalyzed bromination/oxidation of isochromans to benzaldehyde derivatives

A series of isochromans were oxidized and brominated by using 1.2 equiv of CuBr2 in CH3CN at reflux to give the corresponding bromo benzaldehydes in moderate yields. A plausible mechanism for this transformation has been suggested.

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Reference:
Benzodioxan,
1,4-Benzodioxane | C8H8O2 – PubChem

Awesome and Easy Science Experiments about 5-(Bromomethyl)-2,3-dihydro-1,4-benzodioxine

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THE CONFORMATIONAL DEPENDENCE OF 6jPF,C IN SOME 4-FLUOROPHENYL DERIVATIVES OF METHANE, ETHENE, AND CYCLOHEXANE

The spin-spin coupling over six bonds between (19)F and (13)C nuclei on the sidechain in thirteen 4-fluorophenyl derivatives appears to be mediated by a ?-? mechanism.Its magnitude depends somewhat on the hybridization state of the carbon atom carrying the coupled nucleus, as well as on the electronegativity of substituents attached to this carbon atom.A consistent behaviour of this coupling is observed if its value is assumed to be proportional to sin2 theta, where theta is the angle by which the bond carrying the coupled carbon nucleus twists out of the ring plane.However, in the 4-fluorostyrene 6JpF,C is a ? electron coupling in the planar form, so that its magnitude decreases as the vinyl group twists out of the benzene plane.The ?-? contribution to this coupling is smaller than the ? component. 6JpF,C is used to assess the conformational preferences of a number of compounds, including 4-fluoro-alpha-methylstyrene, 4,4′-difluorodiphenylmethane, 1,1-dichloro-2,2-bis(4-fluorophenyl)ethane, and 1-(4-fluorophenyl)-N-methylcyclohexylamine.

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Reference:
Benzodioxan,
1,4-Benzodioxane | C8H8O2 – PubChem

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Facile Access to Challenging ortho-Terphenyls via Merging Two Multi-Step Domino Reactions in One-Pot: A Joint Experimental/Theoretical Study

ortho-Terphenyls are of high interest for medicinal chemistry and materials science, but they are difficult to access. Herein, we demonstrate a straightforward and sustainable synthesis of highly functionalized ortho-terphenyls via joining an organocatalyzed two-step domino reaction (Knoevenagel/vinylogous Michael) with a DABCO/CuBr2 co-catalyzed three-step domino reaction (cyclization/tautomerization/aromatization) in a one-pot process. Overcoming necessity to isolate intermediate products leads to a reduction of energy, costs and waste for a broad scope of reactions. DFT calculations have been performed to investigate the thermodynamics of this one-pot process towards ortho-terphenyls and to study the reaction profile of the vinylogous Michael reaction under inclusion of solvent effects. Role of London dispersion forces in this transformation has been elucidated. It is shown that reaction kinetics and thermodynamics are slightly influenced by dispersion interactions. Furthermore, the addition of dispersion energy donors leads to small changes of reaction energies in some cases.

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Reference:
Benzodioxan,
1,4-Benzodioxane | C8H8O2 – PubChem

Awesome Chemistry Experiments For 214894-89-0

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Development of an Imine Chaperone for Selective C-H Functionalization of Alcohols via Radical Relay

The design of a radical relay chaperone to promote selective C-H functionalizations is described. A saccharin-based imine was found to be uniquely suited to effect C-H amination of alcohols via an in situ generated hemiaminal. This radical chaperone facilitates the mild generation of an N-centered radical while also directing its regioselective H atom transfer (HAT) to the beta carbon of an alcohol. Upon beta C-H halogenation, aminocyclization, and reductive cleavage, an NH2 is formally added vicinal to an alcohol. The development, synthetic utility, and chemo-, regio-, and stereoselectivity of this imine chaperone-mediated C-H amination is presented herein.

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Reference:
Benzodioxan,
1,4-Benzodioxane | C8H8O2 – PubChem

Simple exploration of C9H9BrO2

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INDOLES

A 1,4-substituted cyclic amine derivative represented by the following formula or a pharmacologically acceptable salt thereof: wherein A, B, C, D, T, Y, and Z each represent a methine or a nitrogen linkage; R1, R2, R3, R4, and R5 each represent a substituent; n represents 0 or an integer of 1 to 3; m represents 0 or an integer of 1 to 6; and p represents an integer of 1 to 3. The compounds have serotonin antagonism. They are therefore clinically useful as medicaments, in particular, for treating, ameliorating, and preventing spastic paralysis. They are also useful as central muscle relaxants for ameliorating myotonia.

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Reference:
Benzodioxan,
1,4-Benzodioxane | C8H8O2 – PubChem

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Kinetics of Hydrolysis of Some Acid Succinates in Water

The kinetics of hydrolysis of 1-phenylethyl hydrogen succinate and its p-alkyl (Me, Et), p-methoxy and p-halogen (F, Cl, Br) derivatives has been studied in water.The activation parameters are normal for a BAL 1 mechanism, except for the chloro and bromo derivatives.The Brown-Okomoto equation has also been applied to the present case.

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Reference:
Benzodioxan,
1,4-Benzodioxane | C8H8O2 – PubChem

The important role of C9H9BrO2

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Metal-Free Ammonium Iodide Catalyzed Oxidative Dehydrocoupling of Silanes with Alcohols

An ammonium iodide catalyzed direct oxidative coupling of silanes with alcohols to give various alkoxysilane derivatives was discovered. tert -Butyl hydroperoxide proved to be an efficient oxidant for this transformation. Attractive features of this protocol include its transition-metal-free nature and the mild reaction conditions.

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Reference:
Benzodioxan,
1,4-Benzodioxane | C8H8O2 – PubChem

Discovery of 5-(Bromomethyl)-2,3-dihydro-1,4-benzodioxine

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Cascade bio-hydroxylation and dehalogenation for one-pot enantioselective synthesis of optically active beta-halohydrins from halohydrocarbons

A stereoselective hydroxylation and enantioselective dehalogenation cascade reaction was developed for the synthesis of optically active beta-haloalcohols from halohydrocarbons. This cascade system employed P450 and halohydrin dehalogenase as two compatible biocatalysts, allowing a straightforward, greener and efficient access to beta-halohydrins with excellent enantioselectivities (98-99%).

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Reference:
Benzodioxan,
1,4-Benzodioxane | C8H8O2 – PubChem

Extended knowledge of C9H9BrO2

A reaction mechanism is the microscopic path by which reactants are transformed into products. Each step is an elementary reaction. In my other articles, you can also check out more blogs about 214894-89-0

214894-89-0, In homogeneous catalysis, catalysts are in the same phase as the reactants. Enzymes are biological catalysts that produce large increases in reaction rates and tend to be specific for certain reactants and products. In a document type is Article, and a compound is mentioned, CAS :214894-89-0, Name is 5-(Bromomethyl)-2,3-dihydro-1,4-benzodioxine, introducing its new discovery.

Kinetics of Hydrolysis of Some Acid Succinates in Water

The kinetics of hydrolysis of 1-phenylethyl hydrogen succinate and its p-alkyl (Me, Et), p-methoxy and p-halogen (F, Cl, Br) derivatives has been studied in water.The activation parameters are normal for a BAL 1 mechanism, except for the chloro and bromo derivatives.The Brown-Okomoto equation has also been applied to the present case.

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Reference:
Benzodioxan,
1,4-Benzodioxane | C8H8O2 – PubChem