| 33887-86-4

• 分子结构分类: 有机化合物 - 有机氧化合物
• CAS: 33887-86-4
• 化学式: C₅H₉O₂
• 分子量: 101.125
• InChiKey: NMXPTNPILVLVHT-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.93
• 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：
  0.8
• 拓扑面积：
  18.46
• 氢给体数：
  0.0
• 氢受体数：
  2.0

反应信息

• 作为产物：
  描述：

  2,2-二甲基-1,3-二氧环戊烷 在 二叔丁基过氧化物 作用下， 以 various solvent(s) 为溶剂， 生成
  参考文献：
  名称：

  Griller, David; Nonhebel, Derek C.; Walton, John C., Journal of the Chemical Society. Perkin transactions II, 1984, # 11, p. 1817 - 1822

  摘要：

  DOI：

文献信息

• Lee, Kheng H.; Chin, Kwai-Lan; Brumby, Steven, Journal of the Chemical Society. Perkin transactions II, 1985, p. 161 - 164
  作者：Lee, Kheng H.、Chin, Kwai-Lan、Brumby, Steven

  DOI：——

  日期：——
• Antiradical activity of dioxolane derivatives
  作者：V. B. Vol’eva、I. S. Belostotskaya、N. L. Komissarova、A. V. Malkova、T. V. Pokholok、E. Ya. Davydov

  DOI：10.1134/s1070428013030226

  日期：2013.3

  1,3-Benzodioxoles synthesized by condensation of 3,6-di-tert-butylbenzene-1,2-diol with carbonyl compounds showed antiradical activity due to their ability to undergo one-electron oxidation with formation of stable radical cations. On this basis, the antiknock effect of their structural analogs, 1,3-dioxolanes derived from vicinal diols, was interpreted in terms of oxidation of these compounds with active radicals generated from fuel hydrocarbons to produce more stable radical or radical ion species, depending on the fuel composition. The formation of radical species was detected in model oxidation reactions of 2,2-dimethyl-1,3-dioxolane and 2,2-dimethyl-1,3-dioxolan-4-ylmethanol with radicals generated by photolysis of iron(III) chloride and benzoyl peroxide.
• GERMASH, A. V.;YAKUPOV, I. S.;ZLOTSKIJ, S. S.;RAXMANKULOV, D. L., DOKL. AN CCCP, 295,(1987) N 6, 1389-1390
  作者：GERMASH, A. V.、YAKUPOV, I. S.、ZLOTSKIJ, S. S.、RAXMANKULOV, D. L.

  DOI：——

  日期：——