chlorocyclohexane radical | 83561-08-4

• 分子结构分类: 有机化合物 - 有机卤素化合物 - 有机氯化物
• 英文名称: chlorocyclohexane radical
• CAS: 83561-08-4
• 化学式: C₆H₁₀Cl
• 分子量: 117.598
• InChiKey: QNHYKMHGFOKIEF-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.37
• 重原子数：
  7.0
• 可旋转键数：
  0.0
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.83
• 拓扑面积：
  0.0
• 氢给体数：
  0.0
• 氢受体数：
  0.0

反应信息

• 作为反应物：
  描述：

  chlorocyclohexane radical 以 水 为溶剂， 生成 α-hydroxycyclohexyl radical 、 alkaline earth salt of/the/ methylsulfuric acid
  参考文献：
  名称：

  Fast hydrolysis of alkyl radicals with leaving groups in the β position

  摘要：

  DOI：

  10.1021/ja00389a068
• 作为产物：
  描述：

  氯代环己烷 以 水 为溶剂， 生成 chlorocyclohexane radical
  参考文献：
  名称：

  Fast hydrolysis of alkyl radicals with leaving groups in the β position

  摘要：

  DOI：

  10.1021/ja00389a068

文献信息

• Radiolytic reductions and oxidations in dimethyl sulfoxide solutions: solvent effects on reactivity of halogen atom complexes
  作者：M. Kumar、P. Neta

  DOI：10.1021/j100187a032

  日期：1992.4

  Radiolysis of dimethyl sulfoxide (DMSO) solutions containing various additives was used to achieve clean one-electron reduction of oxidation of solutes. Pulse radiolysis of benzoquinone in DMSO solutions containing acetone and triethylamine permitted conversion of all primary radicals into reducing species. The total yield of reduction in the gamma-radiolysis of methyl viologen solutions was found to be 0.37-mu-mol/J. In the pulse radiolysis of TMPD and triphenylamine in aerated DMSO containing LiCl and/or CCl4, all the primary radicals were converted into oxidizing species and gave a maximum yield of 0.39-mu-mol/J. In the latter systems, oxidation was partly by halogen atom complexes. The reactivity of complexes of DMSO (DMSO.Cl, DMSO.Br) and of halide ions (Br2.-,I2.-) was examined for several organic compounds. DMSO.Cl oxidizes chlorpromazine, triphenylamine, and zinc porphyrin with rate constants of the order of 10(7)-10(8) M-1 s-1, and the rates increase upon addition of CH2Cl2 as well as upon addition of water and formamide. DMSO.Cl also reacts with olefins by addition of Cl to the double bond; the rate constants increase upon increasing the electron-donating properties of the substituents on the double bond. The rate constants for oxidation of chlorpromazine by Br2.- and I2.- increase by more than 2 orders of magnitude upon changing the solvent from DMSO gradually to water. The change was less with acetonitrile/water mixtures, and the difference is probably due to differences in ion solvation.
• Fast hydrolysis of alkyl radicals with leaving groups in the β position
  作者：G. Koltzenburg、G. Behrens、D. Schulte-Frohlinde

  DOI：10.1021/ja00389a068

  日期：1982.12