1,3,5-tribromo-2,4-bis(allyloxymethyl)-6-(bromomethyl)benzene | 479213-72-4

• 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: 1,3,5-tribromo-2,4-bis(allyloxymethyl)-6-(bromomethyl)benzene
• 英文别名: 1,3,5-Tribromo-2-(bromomethyl)-4,6-bis(prop-2-enoxymethyl)benzene
• CAS: 479213-72-4
• 化学式: C₁₅H₁₆Br₄O₂
• 分子量: 547.907
• InChiKey: AACUSFMVOYBEIM-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.1
• 重原子数：
  21
• 可旋转键数：
  9
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.33
• 拓扑面积：
  18.5
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  3-丁烯-1-醇 、 1,3,5-tribromo-2,4-bis(allyloxymethyl)-6-(bromomethyl)benzene 在 sodium hydride 作用下， 以 四氢呋喃 为溶剂， 反应 12.5h， 以82%的产率得到1,3,5-tribromo-2,4-bis(alloxymethyl)-6-(but-3'-enoxymethyl)benzene
  参考文献：
  名称：

  Intramolecular Triple Heck Reaction. An Efficient Entry to Fused Tetracycles with a Benzene Core

  摘要：

  Twelve examples of 1,3,5-tribromo-2,4,6-trienylbenzenes were easily synthesized by alkylation, etherification, and amination methods. Under conditions A and B, a series of tetracycles with a benzene core, i.e., fused 5,6,6-, 6,6,6-, and 6,6,7-tetracyclic compounds, were prepared efficiently via this intramolecular triple Heck reaction protocol.

  DOI：

  10.1021/jo0258094
• 作为产物：
  描述：

  2,4,6-三溴-1,3,5-三甲基苯 在 N-溴代丁二酰亚胺(NBS) 、 sodium hydride 、 过氧化苯甲酰 作用下， 以 四氢呋喃 、 四氯化碳 为溶剂， 反应 8.83h， 生成 1,3,5-tribromo-2,4-bis(allyloxymethyl)-6-(bromomethyl)benzene
  参考文献：
  名称：

  Intramolecular Triple Heck Reaction. An Efficient Entry to Fused Tetracycles with a Benzene Core

  摘要：

  Twelve examples of 1,3,5-tribromo-2,4,6-trienylbenzenes were easily synthesized by alkylation, etherification, and amination methods. Under conditions A and B, a series of tetracycles with a benzene core, i.e., fused 5,6,6-, 6,6,6-, and 6,6,7-tetracyclic compounds, were prepared efficiently via this intramolecular triple Heck reaction protocol.

  DOI：

  10.1021/jo0258094

文献信息

• Intramolecular Triple Heck Reaction. An Efficient Entry to Fused Tetracycles with a Benzene Core
  作者：Shengming Ma、Bukuo Ni

  DOI：10.1021/jo0258094

  日期：2002.11.1

  Twelve examples of 1,3,5-tribromo-2,4,6-trienylbenzenes were easily synthesized by alkylation, etherification, and amination methods. Under conditions A and B, a series of tetracycles with a benzene core, i.e., fused 5,6,6-, 6,6,6-, and 6,6,7-tetracyclic compounds, were prepared efficiently via this intramolecular triple Heck reaction protocol.