4-tert-butyl-2-(cyclohexyloxy)phenol | 610278-80-3

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: 4-tert-butyl-2-(cyclohexyloxy)phenol
• 英文别名: 2-cyclohexyloxy-4-tert-butylphenol；4-tert-butyl-2-cyclohexyloxyphenol
• CAS: 610278-80-3
• 化学式: C₁₆H₂₄O₂
• 分子量: 248.365
• InChiKey: UADKYNICWIHFHK-UHFFFAOYSA-N

物化性质

• 沸点：
  362.3±30.0 °C(Predicted)
• 密度：
  1.030±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  5
• 重原子数：
  18
• 可旋转键数：
  3
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.62
• 拓扑面积：
  29.5
• 氢给体数：
  1
• 氢受体数：
  2

反应信息

• 作为产物：
  描述：

  溴代环己烷 、 对叔丁基邻苯二酚 在 氢氧化钾 作用下， 以 乙醇 为溶剂， 生成 2-cyclohexyloxy-5-tert-butylphenol 、 4-tert-butyl-2-(cyclohexyloxy)phenol
  参考文献：
  名称：

  摘要：

  Products of reactions of tert-butylated pyrocatechols with alkyl radicals were studied. The major products formed upon gamma-irradiation of deaerated solutions of 4-tert-butyl- and 3,5-di-tert-butylpyrocatechol in hexane and cyclohexane are monoalkyl ethers, which were identified by NMR spectroscopy (H-1, C-13, H-1-H-1 NOESY technique) and gas chromatography-mass spectrometry.

  DOI：

  10.1023/a:1024905903115

文献信息

• Reaction of o-Quinones in Cyclohexane Solutions with Alkyl Radicals Generated by Solution γ-Irradiation
  作者：L. A. Maslovskaya、A. I. Savchenko

  DOI：10.1007/s11176-005-0442-4

  日期：2005.9

  The structures of products formed in reactions of tert -butylated o -quinones with alkyl radicals were determined by 1H and 13C NMR and two-dimensional 1H-1H NOESY spectroscopy, and also by gas chromatography-mass spectrometry. The major products formed upon γ-irradiation of deaerated solutions of 4- tert -butyl-1,2-benzoquinone and 3,5-di- tert -butyl-1,2-benzoquinone in cyclohexane are monoalkyl

  通过1 H和13 C NMR和二维1 H - 1 H NOESY光谱，以及通过气相色谱-质谱法确定 叔丁基 化 邻 醌与烷基反应形成的产物的结构 。在4-脱气溶液γ-照射形成的主要产品 叔 丁基-1,2-苯醌和3,5-二- 叔 在环己烷-丁基-1,2-苯醌是单烷基醚和除了产品C ＝ C键。在4- 叔 的情况下 -丁基-1,2-苯醌，这些是混合的OC和CC烷基化的产物；通过将环己基基团加到3,5- 二叔 丁基-1,2-苯醌中的C = C键上形成的加合物 得到不对称二聚体，其结构已通过单晶X射线衍射证明。
• ——
  作者：L. A. Maslovskaya、A. I. Savchenko

  DOI：10.1023/a:1024905903115

  日期：——

  Products of reactions of tert-butylated pyrocatechols with alkyl radicals were studied. The major products formed upon gamma-irradiation of deaerated solutions of 4-tert-butyl- and 3,5-di-tert-butylpyrocatechol in hexane and cyclohexane are monoalkyl ethers, which were identified by NMR spectroscopy (H-1, C-13, H-1-H-1 NOESY technique) and gas chromatography-mass spectrometry.