E-3-chloro-4-methyl-1-(trimethylsilyl)-2-hexenone

• 分子结构分类: 有机化合物 - 有机卤素化合物 - 乙烯基卤化物
• 英文名称: E-3-chloro-4-methyl-1-(trimethylsilyl)-2-hexenone
• 英文别名: (E)-3-chloro-4-methyl-1-trimethylsilylhex-2-en-1-one
• 化学式: C₁₀H₁₉ClOSi
• 分子量: 218.799
• InChiKey: MQUPZEYPRRRSFD-VQHVLOKHSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.6
• 重原子数：
  13
• 可旋转键数：
  4
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.7
• 拓扑面积：
  17.1
• 氢给体数：
  0
• 氢受体数：
  1

反应信息

• 作为反应物：
  描述：

  E-3-chloro-4-methyl-1-(trimethylsilyl)-2-hexenone 反应 72.0h， 生成 3-chloro-4-methyl-1-(trimethylsilyl)-3-hexenone
  参考文献：
  名称：

  A conjugate addition-elimination route to alkenoyltrimethylsilanes

  摘要：

  Monosubstitution of 3,3-dichloro-1-(trimethylsilyl)2-propenone (1) with organocuprates stereoselectively affords E-3-alkyl- and Z-3-phenyl-3-chloro-1-(trimethylsilyl)-2-propenones. Further substitution proceeds stereoselectively as a function of extant and incoming substituents. 1 was also reduced to E-3-chloro-1-(trimethylsilyl)-2-propenone and the latter converted to E-3-alkyl- and E-3-phenyl-1-(trimethylsilyl)-2-propenones.

  DOI：

  10.1016/0040-4020(95)00561-l
• 作为产物：
  描述：

  仲丁基锂 、 (3,3-(dichloro)propenoyl)trimethylsilane 在 copper(l) cyanide 作用下， 生成 3,4-二甲基己烷 、 E-3-chloro-4-methyl-1-(trimethylsilyl)-2-hexenone
  参考文献：
  名称：

  A conjugate addition-elimination route to alkenoyltrimethylsilanes

  摘要：

  Monosubstitution of 3,3-dichloro-1-(trimethylsilyl)2-propenone (1) with organocuprates stereoselectively affords E-3-alkyl- and Z-3-phenyl-3-chloro-1-(trimethylsilyl)-2-propenones. Further substitution proceeds stereoselectively as a function of extant and incoming substituents. 1 was also reduced to E-3-chloro-1-(trimethylsilyl)-2-propenone and the latter converted to E-3-alkyl- and E-3-phenyl-1-(trimethylsilyl)-2-propenones.

  DOI：

  10.1016/0040-4020(95)00561-l

文献信息

• A conjugate addition-elimination route to alkenoyltrimethylsilanes
  作者：Robert F. Cunico、Cui-ping Zhang

  DOI：10.1016/0040-4020(95)00561-l

  日期：1995.1

  Monosubstitution of 3,3-dichloro-1-(trimethylsilyl)2-propenone (1) with organocuprates stereoselectively affords E-3-alkyl- and Z-3-phenyl-3-chloro-1-(trimethylsilyl)-2-propenones. Further substitution proceeds stereoselectively as a function of extant and incoming substituents. 1 was also reduced to E-3-chloro-1-(trimethylsilyl)-2-propenone and the latter converted to E-3-alkyl- and E-3-phenyl-1-(trimethylsilyl)-2-propenones.