4-(2,2-dimethyl-6-methylidenecyclohexyl)but-3-en-2-ol | 472-76-4

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 异戊烯醇脂质
• 英文名称: 4-(2,2-dimethyl-6-methylidenecyclohexyl)but-3-en-2-ol
• CAS: 472-76-4
• 化学式: C₁₃H₂₂O
• 分子量: 194.317
• InChiKey: QMRRUJDIUVCDMC-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.31
• 重原子数：
  14.0
• 可旋转键数：
  2.0
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.69
• 拓扑面积：
  20.23
• 氢给体数：
  1.0
• 氢受体数：
  1.0

反应信息

• 作为反应物：
  描述：

  4-(2,2-dimethyl-6-methylidenecyclohexyl)but-3-en-2-ol 在 manganese(IV) oxide 作用下， 以 氯仿 为溶剂， 反应 6.0h， 生成 γ-紫罗兰酮
  参考文献：
  名称：

  Synthesis and olfactory evaluation of the enantiomerically enriched forms of 7,11-epoxymegastigma-5(6)-en-9-one and 7,11-epoxymegastigma-5(6)-en-9-ols isomers, identified in Passiflora edulis

  摘要：

  A study on the synthesis of the isomers of the natural C-13 norterpenoids derivatives 7,11-epoxymegastigma-5(6)-en-9-one and 7,11-epoxymegastigma-5(6)-en-9-ols is reported. The latter compounds were prepared from readily available racemic alpha-ionone and then resolved by mean of lipase-mediated acetylation. The obtained enantiomerically forms were evaluated for their odour properties. (C) 2005 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetasy.2005.02.021
• 作为产物：
  描述：

  Alpha-紫罗兰醇 在 吡啶 、 氢氧化钾 作用下， 以 甲醇 、 异丙醇 、 xylene 为溶剂， 反应 486.0h， 生成 4-(2,2-dimethyl-6-methylidenecyclohexyl)but-3-en-2-ol
  参考文献：
  名称：

  Synthesis and olfactory evaluation of the enantiomerically enriched forms of 7,11-epoxymegastigma-5(6)-en-9-one and 7,11-epoxymegastigma-5(6)-en-9-ols isomers, identified in Passiflora edulis

  摘要：

  A study on the synthesis of the isomers of the natural C-13 norterpenoids derivatives 7,11-epoxymegastigma-5(6)-en-9-one and 7,11-epoxymegastigma-5(6)-en-9-ols is reported. The latter compounds were prepared from readily available racemic alpha-ionone and then resolved by mean of lipase-mediated acetylation. The obtained enantiomerically forms were evaluated for their odour properties. (C) 2005 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetasy.2005.02.021

文献信息

• Synthesis and olfactory evaluation of the enantiomerically enriched forms of 7,11-epoxymegastigma-5(6)-en-9-one and 7,11-epoxymegastigma-5(6)-en-9-ols isomers, identified in Passiflora edulis
  作者：Elisabetta Brenna、Claudio Fuganti、Stefano Serra

  DOI：10.1016/j.tetasy.2005.02.021

  日期：2005.5

  A study on the synthesis of the isomers of the natural C-13 norterpenoids derivatives 7,11-epoxymegastigma-5(6)-en-9-one and 7,11-epoxymegastigma-5(6)-en-9-ols is reported. The latter compounds were prepared from readily available racemic alpha-ionone and then resolved by mean of lipase-mediated acetylation. The obtained enantiomerically forms were evaluated for their odour properties. (C) 2005 Elsevier Ltd. All rights reserved.