• Title/Summary/Keyword: Benzene ring

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Nucleophilic Displacement at Sulfur Center (VII). Conformation and Ethanolysis of Benzenesulfenyl Chloride (유기 황화합물의 친핵성 치환반응 (제7보). 염화벤젠술페닐의 형태와 가에탄올 분해)

  • Ikchoon Lee;Jae Eui Yie;Dae Hyung Chung
    • Journal of the Korean Chemical Society
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    • v.20 no.1
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    • pp.15-18
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    • 1976
  • The preferred conformation of benzenesulfenyl chloride was determined by EHMO calculation. It was found that the stability was dictated by the n-${\pi}$ conjugation of S atom with the benzene ring. The ethanolysis reaction of benzenesulfenyl chlorides has been studied. The rate constants obtained have been discussed in terms of substituent effects and d-orbital participation of sulfur atom. From a non-linear Hammett plot, bipyramid type of intermediate has been suggested.

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Behaviors of LAS in Reactions with Free Chlorine (鹽素와 反應에서 LAS의 擧動에 관한 연구)

  • Kim, Hea-tae;Lee, Hwan;Lee, Yoon-jin;Nam, Sang-ho
    • Journal of Environmental Health Sciences
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    • v.23 no.2
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    • pp.106-114
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    • 1997
  • When surfactants meet chlorine bleaches not only in the washing drums but also through the whole path from the stream to the river, it is not difficult to expect that they produce the harmful substances like DBPs. Furthermore considering wastewater that is contaminated by surfactants is used to discharge into drinking water sources via sewer system, it also can be imagined that residual surfactants would contribute to the some extent of DBPs' formation during chlorine disinfection in water treatment plants. Although the main behavior observed was the formation of chloroform during the reaction of LAS with free chlorine, the other manifest behaviors like the trends of pH, MBAS, free chlorine, the mole concentration of benzene ring and etc. were also investigated.

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Variation of Insulation Characteristics due to ${\gamma}$-ray Irradiation on LDPE Contained Treeing Inhibitors (트리억제제가 첨가된 LDPE의 방사선 조사에 따른 절연특성 변화)

  • Ryu, Boo-Hyung
    • Journal of the Korean Society of Safety
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    • v.27 no.2
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    • pp.13-19
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    • 2012
  • The effectiveness of treeing resistance in low density polyethylene containing azocompounds were investigated under radiation environments. 4-(4-nitrophenylazo)-1-naphthol and 4-(4-nitrophenylazo) resorcinol were selected for treeing inhibitors. LDPE containing the additives were crosslinked with dicumyl peroxide, irradiated by $Co^{60}$ ${\gamma}$-ray in the presence of air at room temperature. Treeing inception voltage, AC breakdown strength measurements were carried out for electrical insulation characteristics, thermoluminescence and gel contents were analyzed as various irradiation doses also. LDPE with treeing inhibitors showed much better insulation characteristics than pure LDPE. It is interpreted that molecular structures, polar groups and the type of radicals connected on the benzene ring of the additives affected electrical characteristics. From the results, 4-(4-nitrophenylazo) resorcinol was the most effective upon the best treeing and radiation resistance.

Functional Monomers and Polymers (Ⅰ). Polymerization of Acryloyl-Type Monomer Containing Lactam Ring (관능성 단량체 및 중합체 (제1보). Lactam 고리를 함유하고 있는 Acryloyl 형 단량체의 중합)

  • S. K. Noh;G. S. Sur;Sam K. Choi
    • Journal of the Korean Chemical Society
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    • v.24 no.1
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    • pp.64-72
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    • 1980
  • The synthesis of N-acrylylpyrrolidone has been carried out by the reaction of pyrrolidone and acrylyl chloride. The study on the copolymer of N-acrylylpyrrolidone and styrene is attempted.The copolymerization of N-acrylylpyrrolidone and styrene is carried out in benzene.Monomer reactivity ratio of N-acrylylpyrrolidone and styrene was calculated by Fineman and Ross equation. It is observed that the copolymer of N-acrylylpyrrolidone and styrene has random distributed acyl-lactam function on the vinyl polymer backbone.

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Synthesis of Tetracyclic Pyrido[2,3-b]azepine Derivatives as Analogues of Mirtazapine via N-Acyliminium Ion Cyclization

  • Lee, Jae-Yeol;Bang, Sung-Hun;Lee, Sook-Ja;Song, Yun-Seon;Jin, Chang-Bae;Park, Ho-Koon;Lee, Yong-Sup
    • Bulletin of the Korean Chemical Society
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    • v.23 no.11
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    • pp.1623-1628
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    • 2002
  • Tetracyclic pyrido[2,3-b]azepine derivatives 4a-d and 4f as analogues of mirtazapine were synthesized via N-acyliminium ion cyclization by using aromatic rings such as benzene and thiophene ring as a ${\pi}-nucleophile$, and evaluated for the binding affinity for ${\alpha}2-adrenoceptor$. Among tested compounds, 2,3,9,13b-tetrahydro-1H-benzo[f]pyrrolo[2,1-a]pyrido[2,3-c]azepine (4a) was the most potent (Ki = 0.26 ${\mu}M)$ but showed about 3-fold less binding affinity than mirtazapine (Ki = 0.08 ${\mu}M)$ for a2-adrenoceptor.

Theoretical Study of 1,4,6,9-Tetra chlorinated dibenzo-$\rho$-dioxin anion

  • Mhin, Byung-Jin;Odde, Srinivas;Han, Kang-Hyun;Lee, Jung-Eun;Choi, Won-Yong
    • The Journal of Natural Sciences
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    • v.16 no.1
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    • pp.129-141
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    • 2005
  • The equilibrium geometry, adiabatic electron affinity, harmonic vibrational frequencies, and infrared intensities of 1,4,6,9-Tetra chlorinated dibenzo-$\rho$-dioxin anion have been studied using B3LYP method. The local minimum conformation is found to be twisted form with $D_2$ symmetry. The predicted adiabatic electron affinity is 0.54 eV. The predicted inversion barrier between twisted and planar conformers was 0.9 kcal/mol, thus we expect that experimentally observed structure seems to be planar. the characteristic IR band of 1,4,6,9-TCDD anion appears at 1510 $cm^4$, which is a benzene ring skeleton vibration mode related with CaCb and C2C3 bond. this characteristic band could be sued for identication of 1,4,6,9-TCDD anion.

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Radio iodination (II) Radio iodination of various aromatic derivatives in organic solvent at low temperature (放射性 요오드化 反應 (第 II 報) 有機容媒 中에서의 各種 芳香誘導體의 低溫 요오드化 反應)

  • Kim, You-Sun;Kim, Chong-Doo
    • Journal of the Korean Chemical Society
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    • v.12 no.1
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    • pp.35-38
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    • 1968
  • Radio iodination of various aromatic derivatives (aniline, toluene, iodobenzene, acetanilide, benzene, benzoic acid) were achieved at low temperature by a chloroamine-T procedures in presence of polar solvent(dioxane). Organic base (piperidine) was used as the catalyst. Iodine replacement reaction had occured on the aromatic or alicyclic ring by this reaction, and the kind and ratio of iodinated products were proved to be different from those of usual iodide reaction in organic solvent at low temperature. The reactivity of various aromatic or alicyclic compounds towards the present iodination system was evaluated and the scope and limitation of the present procedures in the preparation of radio pharmaceuticals were discussed.

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Vibronic Assignments of Isomeric Trimethylbenzyl Radicals : Revisited

  • Yi, Eun Hye;Yoon, Young Wook;Lee, Sang Kuk
    • Bulletin of the Korean Chemical Society
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    • v.35 no.3
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    • pp.737-742
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    • 2014
  • The vibronic emission spectra of isomeric trimethylbenzyl radicals were reassigned based on substituent effect on electronic transition energy as well as ab initio calculation of the benzyl radical. The electronic transition energy of three isomeric jet-cooled trimethylbenzyl radicals produced by corona discharge of 1,2,3,5-tetramethylbenzene were analyzed using the empirical data of three isomeric methylbenzyl radicals. Calculated data were obtained by summing up the shifts measured from methylbenzyl radicals as well as taking the position and alignment of substituents on the benzene ring into account. The revised assignments show better agreement with observation, and rationalize the validity of the model developed to explain the substituent effect on electronic transition energy of benzyl radicals.

Separation of Lipid-Soluble Component to Decrease Thermal Oxidation of Lard from Spinach (Spinacia oleracea)

  • Hwang, A-Reum;Kim, Moon-Jung;Choe, Eun-Ok
    • Food Science and Biotechnology
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    • v.15 no.2
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    • pp.220-226
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    • 2006
  • Component having antioxidant activity on lard during heating was separated from hexane extract of spinach, and its characteristic chemical structure was speculated through nuclear magnetic resonance spectroscopy, liquid chromatography-mass spectrometry, and Fourier transform infrared spectrophotometry. Lard was heated with hexane-, ethyl ether-, ethyl acetate-, or ethanol extract of spinach at $180^{\circ}C$ for 20 hr. Hexane extract of spinach, having highest antioxidant activity on lard during heating, was fractionated by silicic acid column chromatography (SACC), and SACC fractions having higher antioxidant activity on lard during heating were further separated by thin layer chromatography (TLC). Isolated compound from SACC fractions of hexane extract of spinach by TLC had sugar moieties and benzene ring along with hydroxy, carbonyl, and alkyl groups in the structure.

Study of 4-Nitroazoxybenzenes (Part II) The Nature of $\alpha$-and $\beta$-4-Nitroazoxybenzene in Strongly Acidic Solution (4-Nitroazoxybenzene에 關한 硏究 (第2報) 强酸 溶液中에서의 $\alpha$- 및 $\beta$-4-Nitroazoxybenzene의 性質)

  • Chi Sun Hahn
    • Journal of the Korean Chemical Society
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    • v.7 no.4
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    • pp.225-229
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    • 1963
  • The nature of the two isomers of 4-nitroazoxybenzenes in strongly acidic solution have been analyzed by U.V. spectrophotometry. Oxygen atom in the azoxy-group of $\alpha$-and $\beta$-4-nitroazoxybenzene in strong acid solution migrates neither to para position nor ortho position of the unsubstituted benzene ring of the compound in contrast with the cases of methyl-and bromo-substituted azoxybenzene, and shown no Wallach rearrangement. Since the $^1A{\rightarrow}^1H$ bands of the spectra shown hyperchromic effect whereas the ${\pi}{\rightarrow}{\pi}^*$ bands of them exhibit extream hypochromic effect, it appears most likely that trans ${\rightarrow}$cis isomerization take place in the media. A mechanism of a triangular transition state by which the transformation might be proceeded, is proposed.

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