(E)-6-hydroxy-2,6-dimethylocta-2,7-dien-1-yl acetate | 64777-00-0

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 脂肪酰基
• 英文名称: (E)-6-hydroxy-2,6-dimethylocta-2,7-dien-1-yl acetate
• 英文别名: 8-acetoxylinalool；(E)-8-acetoxy-3,7-dimethyl-1,6-octadiene-3-ol；[(2E)-6-hydroxy-2,6-dimethylocta-2,7-dienyl] acetate
• CAS: 64777-00-0
• 化学式: C₁₂H₂₀O₃
• 分子量: 212.289
• InChiKey: BOJXRPGLMTUOEQ-JXMROGBWSA-N

物化性质

• 沸点：
  302.5±42.0 °C(Predicted)
• 密度：
  0.982±0.06 g/cm3(Predicted)
• 保留指数：
  2362

计算性质

• 辛醇/水分配系数(LogP)：
  2.1
• 重原子数：
  15
• 可旋转键数：
  7
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.58
• 拓扑面积：
  46.5
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  6-氯-3,7-二甲基辛-1,7-二烯-3-醇 以 N,N-二甲基乙酰胺 为溶剂， 以60% and 29%的产率得到(E)-6-hydroxy-2,6-dimethylocta-2,7-dien-1-yl acetate
  参考文献：
  名称：

  Functionalization of terminal trisubstituted alkenes and derivatives

  摘要：

  该发明涉及一种制备具有以下一般结构的化合物的过程：其中R是氢或包含1到约10个碳原子的非环状或脂环状片段，R1是氢或含有1到约4个碳原子的烷基或芳基。

  公开号：

  US04510319A1

文献信息

• Chirality and biosynthesis of lilac compounds in Actinidia arguta flowers
  作者：A.J. Matich、B.J. Bunn、D.J. Comeskey、M.B. Hunt、D.D. Rowan

  DOI：10.1016/j.phytochem.2007.03.023

  日期：2007.7

  Biosynthesis of lilac compounds in 'Hortgem Tahi' kiwifruit (Actinidia arguta) flowers was investigated by treating inflorescences with d(5)-linalool. The incorporation of the deuterium label into 8-hydroxylinalool, 8-oxolinalool, the lilac aldehydes, alcohols, and alcohol epoxides was followed by GGMS and enantioselective GC-MS. Both (R)- and (S)-linalool were produced naturally by the flowers, but 8-hydroxylinalool, 8-oxolinalool, and the lilac aldehydes and alcohols occurred predominantly as the (S) and 5'(S)-diastereoisomers, respectively. The enantio selective step in the biosynthesis of the lilac aldehydes and alcohols was concluded to be the oxidation of linalool to (S)-8-hydroxylinalool. In contrast, the lilac alcohol epoxides had a 5'(R):(S) ratio, the same as for linalool, which suggests that either these compounds are not synthesised from the 5'(S)-configured lilac aldehydes and alcohols, or that if indeed they are, then it is by an enantioselective step that favours utilisation of the 5'(R)-configured compounds. (c) 2007 Elsevier Ltd. All rights reserved.
• US4510319A
  申请人：——

  公开号：US4510319A

  公开（公告）日：1985-04-09