2-Butyl-1,1,3-trimethylbicyclo<2.2.2>octan-2-ol | 144340-77-2

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 2-Butyl-1,1,3-trimethylbicyclo<2.2.2>octan-2-ol
• 英文别名: 2-butyl-1,3,3-trimethylbicyclo[2.2.2]octan-2-ol
• CAS: 144340-77-2
• 化学式: C₁₅H₂₈O
• 分子量: 224.387
• InChiKey: IUBWEAJZTUIYFE-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.14
• 重原子数：
  16.0
• 可旋转键数：
  3.0
• 环数：
  3.0
• sp3杂化的碳原子比例：
  1.0
• 拓扑面积：
  20.23
• 氢给体数：
  1.0
• 氢受体数：
  1.0

反应信息

• 作为产物：
  描述：

  2,6,6-三甲基-2,4-环己二烯-1-酮 在 palladium on activated charcoal 氢气 作用下， 以 乙醚 、 正己烷 、 乙酸乙酯 、 苯 为溶剂， 85.0 ℃ 、8.11 MPa 条件下， 反应 4.5h， 生成 2-Butyl-1,1,3-trimethylbicyclo<2.2.2>octan-2-ol
  参考文献：
  名称：

  A study on the structure/odour relationship of norpatchoulenol and patchoulol, II

  摘要：

  In continuation of studying structure/odour relationships of odourous compounds, the tricyclic patchouli-system is degraded to bicyclic structures by cutting the C6-C-7 bond (8 and 9) or by omitting the methylene group of C-11 (12). The olfactory properties are studied and described by using the key odour descriptors - woody, earthy, and camphoraceous.

  DOI：

  10.1007/bf00816853

文献信息

• A study on the structure/odour relationship of norpatchoulenol and patchoulol, II
  作者：Helmut Spreitzer

  DOI：10.1007/bf00816853

  日期：——

  In continuation of studying structure/odour relationships of odourous compounds, the tricyclic patchouli-system is degraded to bicyclic structures by cutting the C6-C-7 bond (8 and 9) or by omitting the methylene group of C-11 (12). The olfactory properties are studied and described by using the key odour descriptors - woody, earthy, and camphoraceous.