7-[Tert-butyl(dimethyl)silyl]oxy-2-methylhepta-3,5-diyn-2-ol | 138139-59-0

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 7-[Tert-butyl(dimethyl)silyl]oxy-2-methylhepta-3,5-diyn-2-ol
• CAS: 138139-59-0
• 化学式: C₁₄H₂₄O₂Si
• 分子量: 252.429
• InChiKey: HXSDTTDRCBKYFE-UHFFFAOYSA-N

物化性质

• 沸点：
  306.4±27.0 °C(Predicted)
• 密度：
  0.949±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  2.79
• 重原子数：
  17
• 可旋转键数：
  5
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.71
• 拓扑面积：
  29.5
• 氢给体数：
  1
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  7-[Tert-butyl(dimethyl)silyl]oxy-2-methylhepta-3,5-diyn-2-ol 在 sodium hydroxide 作用下， 以 正己烷 为溶剂， 反应 3.0h， 生成 tert-butyldimethyl(penta-2,4,-diyn-1-yloxy)silane
  参考文献：
  名称：

  Regio- and stereoselectivity in the concatenated enyne cross metathesis–metallotropic [1,3]-shift of terminal 1,3-diyne

  摘要：

  Enyne cross metathesis of terminal 1,3-diynes with various alkenes afforded two products of distinctive connectivity, as the result of a uniform mode of initiation but different modes of termination events with or without metallotropic [1,3]-shift. Steric and electronic factors of the substituents on the 1,3-diynes play an important role in controlling the metallotropic [1,3]-shift of the propagating allcylidene intermediates and their regioselective trapping to the final products. (C) 2013 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tet.2013.08.024
• 作为产物：
  描述：

  4-溴-2-甲基丁-3-炔-2-醇 、 叔丁基二甲基(2-丙炔氧基)硅烷 在 盐酸羟胺 、 正丁胺 、 copper(l) chloride 作用下， 以 水 为溶剂， 反应 0.17h， 生成 7-[Tert-butyl(dimethyl)silyl]oxy-2-methylhepta-3,5-diyn-2-ol
  参考文献：
  名称：

  Regio- and stereoselectivity in the concatenated enyne cross metathesis–metallotropic [1,3]-shift of terminal 1,3-diyne

  摘要：

  Enyne cross metathesis of terminal 1,3-diynes with various alkenes afforded two products of distinctive connectivity, as the result of a uniform mode of initiation but different modes of termination events with or without metallotropic [1,3]-shift. Steric and electronic factors of the substituents on the 1,3-diynes play an important role in controlling the metallotropic [1,3]-shift of the propagating allcylidene intermediates and their regioselective trapping to the final products. (C) 2013 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tet.2013.08.024

文献信息

• Regio- and stereoselectivity in the concatenated enyne cross metathesis–metallotropic [1,3]-shift of terminal 1,3-diyne
  作者：Kung-Pern Wang、Eun Jin Cho、Sang Young Yun、Jee Young Rhee、Daesung Lee

  DOI：10.1016/j.tet.2013.08.024

  日期：2013.10

  Enyne cross metathesis of terminal 1,3-diynes with various alkenes afforded two products of distinctive connectivity, as the result of a uniform mode of initiation but different modes of termination events with or without metallotropic [1,3]-shift. Steric and electronic factors of the substituents on the 1,3-diynes play an important role in controlling the metallotropic [1,3]-shift of the propagating allcylidene intermediates and their regioselective trapping to the final products. (C) 2013 Elsevier Ltd. All rights reserved.