2-(2,2-dibromovinyl)-1-isocyanatobenzene | 1233516-74-9

• 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: 2-(2,2-dibromovinyl)-1-isocyanatobenzene
• 英文别名: 1-(2,2-Dibromoethenyl)-2-isocyanatobenzene
• CAS: 1233516-74-9
• 化学式: C₉H₅Br₂NO
• 分子量: 302.953
• InChiKey: QWDNUGOAUBOYJI-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.7
• 重原子数：
  13
• 可旋转键数：
  2
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  29.4
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  2-(2,2-dibromovinyl)-1-isocyanatobenzene 、 N-甲基-1-萘胺 以 甲苯 为溶剂， 生成
  参考文献：
  名称：

  One-Pot Synthesis of Pyrimido[1,6-a]indol-1(2H)-one Derivatives by a Nucleophilic Addition/Cu-Catalyzed N-Arylation/Pd-Catalyzed C−H Activation Sequential Process

  摘要：

  A novel and convenient one-pot synthesis of pyrimido[1,6-a]indol-1(2H)-one derivatives through a nucleophilic addition/Cu-catalyzed N-arylation/Pd-catalyzed C H activation sequential process is described. The reaction of easily prepared ortho-gem-dibromovinyl isocyanates with N-alkylanilines gave the desired indole derivatives in moderate to good yields.

  DOI：

  10.1021/ol101041e
• 作为产物：
  描述：

  三光气 、 2-(2,2-二溴乙烯基)苯胺 在 三乙胺 作用下， 以 甲苯 为溶剂， 以81%的产率得到2-(2,2-dibromovinyl)-1-isocyanatobenzene
  参考文献：
  名称：

  One-Pot Synthesis of Pyrimido[1,6-a]indol-1(2H)-one Derivatives by a Nucleophilic Addition/Cu-Catalyzed N-Arylation/Pd-Catalyzed C−H Activation Sequential Process

  摘要：

  A novel and convenient one-pot synthesis of pyrimido[1,6-a]indol-1(2H)-one derivatives through a nucleophilic addition/Cu-catalyzed N-arylation/Pd-catalyzed C H activation sequential process is described. The reaction of easily prepared ortho-gem-dibromovinyl isocyanates with N-alkylanilines gave the desired indole derivatives in moderate to good yields.

  DOI：

  10.1021/ol101041e

文献信息

• One-Pot Synthesis of Pyrimido[1,6-<i>a</i>]indol-1(2<i>H</i>)-one Derivatives by a Nucleophilic Addition/Cu-Catalyzed N-Arylation/Pd-Catalyzed C−H Activation Sequential Process
  作者：Zhi-Jing Wang、Jian-Guo Yang、Fan Yang、Weiliang Bao

  DOI：10.1021/ol101041e

  日期：2010.7.2

  A novel and convenient one-pot synthesis of pyrimido[1,6-a]indol-1(2H)-one derivatives through a nucleophilic addition/Cu-catalyzed N-arylation/Pd-catalyzed C H activation sequential process is described. The reaction of easily prepared ortho-gem-dibromovinyl isocyanates with N-alkylanilines gave the desired indole derivatives in moderate to good yields.