Undeca-1,10-diyn-3-ol | 1225377-04-7

• 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: Undeca-1,10-diyn-3-ol
• CAS: 1225377-04-7
• 化学式: C₁₁H₁₆O
• 分子量: 164.247
• InChiKey: OGYZWCPLBJRSRF-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.6
• 重原子数：
  12
• 可旋转键数：
  6
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.64
• 拓扑面积：
  20.2
• 氢给体数：
  1
• 氢受体数：
  1

反应信息

• 作为反应物：
  描述：

  Undeca-1,10-diyn-3-ol 在 二乙胺基三氟化硫 作用下， 以 二氯甲烷 为溶剂， 反应 0.33h， 以65%的产率得到3-Fluoroundeca-1,10-diyne
  参考文献：
  名称：

  Effect of fluorine or oxygen atom(s) in propargylic position on the reactivity in click chemistry

  摘要：

  The use of especially designed omega-diynes allows to establish, through competitive reactions, the effect of C-F, C-OH, CF(2), C=0 and C(OMe)(2) substituents on the reactivity of neighbouring triple bonds in click chemistry and this gives not only a reactivity scale but also a direct access to the difference in activation energies between the competitive reaction pathways. (C) 2010 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2010.02.083
• 作为产物：
  描述：

  壬-8-炔醛 、 乙炔基溴化镁 以 四氢呋喃 为溶剂， 反应 3.0h， 以72%的产率得到Undeca-1,10-diyn-3-ol
  参考文献：
  名称：

  Effect of fluorine or oxygen atom(s) in propargylic position on the reactivity in click chemistry

  摘要：

  The use of especially designed omega-diynes allows to establish, through competitive reactions, the effect of C-F, C-OH, CF(2), C=0 and C(OMe)(2) substituents on the reactivity of neighbouring triple bonds in click chemistry and this gives not only a reactivity scale but also a direct access to the difference in activation energies between the competitive reaction pathways. (C) 2010 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2010.02.083

文献信息

• US4620045A
  申请人：——

  公开号：US4620045A

  公开（公告）日：1986-10-28
• Effect of fluorine or oxygen atom(s) in propargylic position on the reactivity in click chemistry
  作者：Danielle Grée、René Grée

  DOI：10.1016/j.tetlet.2010.02.083

  日期：2010.4

  The use of especially designed omega-diynes allows to establish, through competitive reactions, the effect of C-F, C-OH, CF(2), C=0 and C(OMe)(2) substituents on the reactivity of neighbouring triple bonds in click chemistry and this gives not only a reactivity scale but also a direct access to the difference in activation energies between the competitive reaction pathways. (C) 2010 Elsevier Ltd. All rights reserved.