[1-Iodo-1-(4-phenylbut-3-yn-2-yl)-2,5,5-tris(trimethylsilyl)stannolan-2-yl]-trimethylsilane | 1035852-68-6

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: [1-Iodo-1-(4-phenylbut-3-yn-2-yl)-2,5,5-tris(trimethylsilyl)stannolan-2-yl]-trimethylsilane
• CAS: 1035852-68-6
• 化学式: C₂₆H₄₉ISi₄Sn
• 分子量: 719.632
• InChiKey: NNZQHOGAKDTZKB-UHFFFAOYSA-M

计算性质

• 辛醇/水分配系数(LogP)：
  9.59
• 重原子数：
  32
• 可旋转键数：
  6
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.69
• 拓扑面积：
  0
• 氢给体数：
  0
• 氢受体数：
  0

反应信息

• 作为产物：
  描述：

  2,2,5,5-tetrakis(trimethylsilyl)-1-stannacyclopentane-1,1-diyl 、 1-苯基-1-丁炔 、 1-iodo-2,4,6-triisopropylbenzene 以 further solvent(s) 为溶剂， 生成 [1-Iodo-1-(4-phenylbut-3-yn-2-yl)-2,5,5-tris(trimethylsilyl)stannolan-2-yl]-trimethylsilane
  参考文献：
  名称：

  Direct Formation of Propargyltin Compounds via C−H Activation

  摘要：

  The mixed reagent[GRAPHICS]ArI reacts with alkynes to give primary and secondary propargylic C-H activation. Alkynes tested include I-phenylpropyne, 1-phenylbutyne, 1-trimethylsilylhexyne, and 2-hexyne. Aryl halides tested include iodobenzene and 2,4,6-triisopropyliodobenzene. An X-ray crystal structure is reported for the product of the secondary propargylic activation of 2-hexyne.

  DOI：

  10.1021/om800132h

文献信息

• Direct Formation of Propargyltin Compounds via C−H Activation
  作者：Ajdin Kavara、Jeff W. Kampf、Mark M. Banaszak Holl

  DOI：10.1021/om800132h

  日期：2008.7.1

  The mixed reagent[GRAPHICS]ArI reacts with alkynes to give primary and secondary propargylic C-H activation. Alkynes tested include I-phenylpropyne, 1-phenylbutyne, 1-trimethylsilylhexyne, and 2-hexyne. Aryl halides tested include iodobenzene and 2,4,6-triisopropyliodobenzene. An X-ray crystal structure is reported for the product of the secondary propargylic activation of 2-hexyne.