2-(Cyclohexylmethoxy)cyclohexa-2,5-diene-1,4-dione

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 2-(Cyclohexylmethoxy)cyclohexa-2,5-diene-1,4-dione
• 化学式: C₁₃H₁₆O₃
• 分子量: 220.268
• InChiKey: IAQSDGIAOZNRHK-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.3
• 重原子数：
  16
• 可旋转键数：
  3
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.54
• 拓扑面积：
  43.4
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  2-(Cyclohexylmethoxy)cyclohexa-2,5-diene-1,4-dione 在 titanium(IV) isopropylate 、 硫酸 、 四氯化钛 作用下， 以 二氯甲烷 为溶剂， 反应 0.41h， 生成 (6aS,11aS)-9-Cyclohexylmethoxy-3-methoxy-6a,11a-dihydro-6H-benzo[4,5]furo[3,2-c]chromen-8-ol
  参考文献：
  名称：

  Stereoselective syntheses of substituted pterocarpans with anti-HIV activity, and 5-aza-/5-thia-pterocarpan and 2-aryl-2,3-dihydrobenzofuran analogues

  摘要：

  Oxygenated pterocarpans and 5-azapterocarpans are prepared utilizing Lewis acid-promoted reactions of 2-alkoxy-1,4-benzoquinones with 2H-chromenes and N-tosyl-3,2-dihydroquinolines, respectively. Similarly, benzannulated analogues are prepared via reactions of 5-alkoxy-1,4-naphthoquinones with chromenes, and related 2-aryl-2,3-dihydrobenzofurans result from reactions of styrenes with the quinones. Syntheses of 5-thiapterocarpans are also described utilizing Pd(0)-coupling of o-chloromercuriophenols with 2H-chromenes. Copyright (C) 1996 Elsevier Science Ltd

  DOI：

  10.1016/0968-0896(96)00192-7

文献信息

• Stereoselective syntheses of substituted pterocarpans with anti-HIV activity, and 5-aza-/5-thia-pterocarpan and 2-aryl-2,3-dihydrobenzofuran analogues
  作者：Thomas A. Engler、Kenneth O. LaTessa、Rajesh Iyengar、Wenying Chai、Konstantinos Agrios

  DOI：10.1016/0968-0896(96)00192-7

  日期：1996.10

  Oxygenated pterocarpans and 5-azapterocarpans are prepared utilizing Lewis acid-promoted reactions of 2-alkoxy-1,4-benzoquinones with 2H-chromenes and N-tosyl-3,2-dihydroquinolines, respectively. Similarly, benzannulated analogues are prepared via reactions of 5-alkoxy-1,4-naphthoquinones with chromenes, and related 2-aryl-2,3-dihydrobenzofurans result from reactions of styrenes with the quinones. Syntheses of 5-thiapterocarpans are also described utilizing Pd(0)-coupling of o-chloromercuriophenols with 2H-chromenes. Copyright (C) 1996 Elsevier Science Ltd