7-Butyl-3-methoxycyclohepta-1,3,5-triene | 126893-53-6

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 7-Butyl-3-methoxycyclohepta-1,3,5-triene
• CAS: 126893-53-6
• 化学式: C₁₂H₁₈O
• 分子量: 178.274
• InChiKey: GBACBOFMYNXCGA-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.3
• 重原子数：
  13
• 可旋转键数：
  4
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.5
• 拓扑面积：
  9.2
• 氢给体数：
  0
• 氢受体数：
  1

反应信息

• 作为反应物：
  描述：

  7-Butyl-3-methoxycyclohepta-1,3,5-triene 在 正丁基锂 、 sodium methylate 、 四乙基对甲苯磺酸铵 作用下， 反应 0.5h， 生成 3-Butyl-7,7-dimethoxy-1-methylcyclohepta-1,3,5-triene
  参考文献：
  名称：

  Regioselective synthesis of substituted tropones and azulenes using anodic oxidation of cycloheptatriene systems as the key reaction

  摘要：

  Regioselective synthesis of di- and trisubstituted tropones has been attained by utilizing anodic oxidation of cycloheptatriene systems as the key reaction. This anodic oxidation has also been found to be useful for the regioselective synthesis of mono- and disubstituted azulenes.

  DOI：

  10.1016/s0040-4039(00)74254-7
• 作为产物：
  描述：

  环庚三烯 在 sodium methylate 、 四乙基对甲苯磺酸铵 作用下， 以 乙醚 为溶剂， 反应 9.0h， 生成 7-Butyl-3-methoxycyclohepta-1,3,5-triene
  参考文献：
  名称：

  环庚三烯体系的阳极氧化及其在合成非苯类芳族化合物中的应用

  摘要：

  现已发现，环庚烯的阳极氧化是制备各种非苯甲酸酯类芳香族化合物（如对甲苯二铵盐，托洛酮，对苯二酚，2H-环庚[b]呋喃-2-酮和天青石。

  DOI：

  10.1016/s0040-4020(01)87049-6

文献信息

• A novel regioselective synthesis of 4-substituted tropones
  作者：Shono Tatsuya、Naekawa Hirofuni、Nozoe Tetsuo、Kashimura Shigenori

  DOI：10.1016/s0040-4039(00)94657-4

  日期：1990.1

  The preparation of 4-alkyl (or aryl) tropones has easily been accomplished by the anodic oxidation of 1-methoxy-4-alkyl (or aryl) cycloheptatrienes which were synthesized by the regioselective addition of alkyl or aryl lithium to 3-position of 7,7-dimethoxyeycloheptatriene followed by the thermal 1,5-hydrogen shift of the resulting 3-methoxy-7-alkyl (or aryl) cycloheptatrienes.

  通过对1-甲氧基-4-烷基（或芳基）环庚烯进行阳极氧化，可以很容易地完成4-烷基（或芳基）六氢萘酮的制备，这是通过将烷基或芳基锂的区域选择性加成至7的3位而合成的。 1,7-二甲氧基环庚三烯，然后将所得的3-甲氧基-7-烷基（或芳基）环庚烯进行热1,5-氢转移。
• SHONO, TATSUYA;MAEKAWA, HIROFUMI;NOZOE, TETSUO;KASHIMURA, SHIGENORI, TETRAHEDRON LETT., 31,(1990) N, C. 895-898
  作者：SHONO, TATSUYA、MAEKAWA, HIROFUMI、NOZOE, TETSUO、KASHIMURA, SHIGENORI

  DOI：——

  日期：——
• Anodic oxidation of cycloheptatriene systems and its application to the synthesis of non-benzenoid aromatic compounds
  作者：Tatsuya Shono、Tetsuo Nozoe、Hirofumi Maekawa、Yoshihide Yamaguchi、Shinya Kanetaka、Haruhisa Masuda、Toshio Okada、Shigenori Kashimura

  DOI：10.1016/s0040-4020(01)87049-6

  日期：1991.1

  Anodic oxidation of cycloheptatrienes has been found to be one of the most powerful key tools for the preparation of a variety of non-benzenoid aromatic compounds such as tropylium salts, tropones, tropolones, 2H-cyclohepta[b]furan-2-ones, and azulenes.

  现已发现，环庚烯的阳极氧化是制备各种非苯甲酸酯类芳香族化合物（如对甲苯二铵盐，托洛酮，对苯二酚，2H-环庚[b]呋喃-2-酮和天青石。
• Regioselective synthesis of substituted tropones and azulenes using anodic oxidation of cycloheptatriene systems as the key reaction
  作者：Tatsuya Shono、Toshio Okada、Tsuyoshi Furuse、Shigenori Kashimura、Tetsuo Nozoe、Hirofumi Maekawa

  DOI：10.1016/s0040-4039(00)74254-7

  日期：1992.7

  Regioselective synthesis of di- and trisubstituted tropones has been attained by utilizing anodic oxidation of cycloheptatriene systems as the key reaction. This anodic oxidation has also been found to be useful for the regioselective synthesis of mono- and disubstituted azulenes.