• Journal of the Korean Chemical Society
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• v.38 no.1
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• pp.61-68
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• 1994

The intramolecular formal iron-catalyzed [4+2] cycloaddition reaction of acetylenic dienes to produce bicyclic products has been investigated. These reactions proceeded, competing via intramolecular carbocyclization and bimolecular cycloaddition. However, the iron-catalyzed bicyclic carbocyclization of 4,4-dimethyl-3-(tert-butyldimethylsiloxy)-1-phenyl-6,8-decadien-1-yne(11) yielded exclusively bicyclic diene product(yield 78.1%). From this result, we found that the substrate containing a dimethyl substitutent at the 4,4-position helped to promote the intramolecular reaction, which is stable to the iron catalyzed conditions.

• Journal of the Korean Chemical Society
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• v.48 no.3
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• pp.331-334
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• 2004

• Journal of the Korean Chemical Society
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• v.30 no.2
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• pp.248-258
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• 1986

The electronic structures and geometries of model substituted oxiranes, and carbonyl ylides containing cyano, methoxy and thiomethoxy substituents were investigated by MNDO-SCF-MO method. Stabilization and geometries caused by substituents, the ease of formation of carbonyl ylides from oxiranes and the reactivities of the cycloaddition of substituted carbonyl ylides were investigated.

• Journal of the Korea Institute of Military Science and Technology
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• v.18 no.6
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• pp.736-742
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• 2015

The effect of pressure on 1,3-dipolar cycloaddtion has been studied by means of FT-IR and NMR spectroscopy. Pressure accelerates 1,3-dipolar cycloaddition without solvent or catalyst. This simple and inexpensive method eliminates the need for work-up or purification. The method is expected to be applied to the synthesis of binders for solid rocket propellants.

• Journal of the Korean Chemical Society
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• v.47 no.6
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• pp.591-596
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• 2003

Aminothienopyridazines 1a, b and aminothienocoumarin 2 condensed with DMFDMA to yield amidines 3a, b and 4. These compounds reacted with N-phenylmaleimide to yield 9 and 10. On the other hand reacting 3a, b, 4, 18, 19 and 20 with maleic anhydride afforded only the formylated derivatives 5a, b, 6, 21, 22 and 23 respectively. The reaction of 3a, b with diethyl fumarate afforded 11, formed most likely via hydrolysis of the amidine 14 during working up the reaction mixture. Irradiation of N-phenylmaleimide in microwave oven afforded [2+2] and [2+2+2] cycloaddition product.

• Journal of the Korean Chemical Society
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• v.21 no.3
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• pp.155-160
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• 1977

HMO correlation diagrams for some competing 1,2-and 1,4-cycloaddition reactions have been made to elucidate the reaction mechanism. The main conclusions obtained from this study are as follows. 1) The crossing between the highest occupied molecular orbital and the lowest unoccupied molecular orbital was not observed, which indicates that the reaction proceeds thermally, in agreement with the experimental results. 2) From the consideration of the energy barrier in the process of the energy transformation going from reactants to product, the two-step mechanism via a diradical intermediate is preferred over the concerted one. 3) The existance of diradical intermediates can account for the observed product distributions.

• Journal of the Korean Chemical Society
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• v.30 no.2
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• pp.243-247
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• 1986

The cycloaddition between homophthalic anhydrides (1 or 2) and diethyl azodicarboxylate and ethyl arylmetbyldenecarbamates was investigated. The former led to 2,3-diethoxycarbonyl-2,3-dihydro-1-hydroxyphthalazines (3 and 4), while the latter gave 3-aryl-4-carboxy-2-ethoxycarbonyl-3,4-dihydro-1(2H) isoquinolinones (5∼10).

• Journal of the Korean Chemical Society
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• v.36 no.2
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• pp.287-292
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• 1992

The rate constants of the nucleophilic addition reaction of amines (piperidine and diethylamine) to phenylvinylketone in various solvents have been determined by UV spectrophotometry at $25^{\circ}C$. On the basis of the high sensitivity of the rate to the polarity of the medium, it may be concluded that the reaction intermediate has zwitterionic character. The effect of the solvents on the rate of the bimolecular nucleophilic addition reaction is described well by the Kirkwood equation: The transition state of the reaction has a cyclic structure formed through an intramolecular hydrogen bond. The addition reaction of primary and secondary amines to phenylvinylketone in all solvents take place considerably faster than that of tertiary amine and this results also can be explained by the intermediate products in the reaction have a cyclic structure formed through an intramolecular hydrogen bond for the primary and secondary amines but not for the tertiary amine.

• Journal of the Korean Chemical Society
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• v.65 no.1
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• pp.9-14
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• 2021

In this study, the DFT calculation was performed using the B3LYP/6-31G(d,p) basis sets for the reaction process in which phenanthrene decomposes due to the chain reaction of two OH radicals on phenanthrene in the gaseous state of 298 K at 1 atm. As a result of the calculation, even when two OH radicals act on phenanthrene in a chain, the reaction for producing phenanthren-9-ol is predicted to be more advantageous than the reaction for producing phenanthren-1-ol. On the other hand, it was predicted that the OH addition process at room temperature would be advantageous for the priority of the OH addition and H abstraction process.

• Applied Chemistry for Engineering
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• v.16 no.5
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• pp.712-718
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• 2005

This research was conducted to evaluate the effect of recycled-water addition on the treatment of coar tar-contaminated soil with slurry phase bioreactor. A bench-scale slurry phase bioreactor was maintained to optimize the microbial growth. Silty loam soil was used for this research. Concentrations of coal tar and 14 target PAHs (Polyunclear Aromatic Hydrocarbons) in the soil were determined with gas chromatography. Addition of recycled-water to slurry phase bioreactor was not significantly increased the removal efficiency of 2000 mg coar tar/kg. However, it significantly increased the removal efficiency of 20000 mg coar tar/kg. In 20000 mg coar tar/kg, the first order kinetic constant and the removal efficiency of the reactor with recycled-water addition were 2.5 and 2.0 times higher than those of the reactor without recycled- water addition. Coar tar in the slurry phase bioreactor was removed in 3.8~16.0% by vaporization and biodegraded in 84.0~96.2%. Removal efficiency of 3-ring compounds was high as 92.2~99.7% in the case of recycled-water addition. However, removal efficiencies of 3 and 4-ring compounds were low as 0~30%.