dibenzyl benzo[b]thiophene-2,3-dicarboxylate | 1429655-34-4

• 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: dibenzyl benzo[b]thiophene-2,3-dicarboxylate
• 英文别名: Dibenzyl 1-benzothiophene-2,3-dicarboxylate；dibenzyl 1-benzothiophene-2,3-dicarboxylate
• CAS: 1429655-34-4
• 化学式: C₂₄H₁₈O₄S
• 分子量: 402.471
• InChiKey: SGTUQPQATCQPLU-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6
• 重原子数：
  29
• 可旋转键数：
  8
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.08
• 拓扑面积：
  80.8
• 氢给体数：
  0
• 氢受体数：
  5

反应信息

• 作为产物：
  描述：

  dibenzylacetylene dicarboxylate 、 苯硫酚 在 氧气 、 manganese(II) acetate 、 苯甲酸 作用下， 以 1,2-二氯乙烷 为溶剂， 反应 2.0h， 以67%的产率得到dibenzyl benzo[b]thiophene-2,3-dicarboxylate
  参考文献：
  名称：

  Direct Benzothiophene Formation via Oxygen-Triggered Intermolecular Cyclization of Thiophenols and Alkynes Assisted by Manganese/PhCOOH

  摘要：

  An intermolecular oxidative cyclization between thiophenols and alkynes for benzothiophene formation has been established. A variety of multifunctional benzothiophenes are synthesized. In addition, we demonstrated that the obtained benzothiophenes can be used for further transformation to give diverse benzothiophene derivatives efficiently and selectively.

  DOI：

  10.1021/ol400719d

文献信息

• Direct Benzothiophene Formation via Oxygen-Triggered Intermolecular Cyclization of Thiophenols and Alkynes Assisted by Manganese/PhCOOH
  作者：Kaisheng Liu、Fan Jia、Hui Xi、Yuanming Li、Xiaojian Zheng、Qiaoxia Guo、Baojian Shen、Zhiping Li

  DOI：10.1021/ol400719d

  日期：2013.4.19

  An intermolecular oxidative cyclization between thiophenols and alkynes for benzothiophene formation has been established. A variety of multifunctional benzothiophenes are synthesized. In addition, we demonstrated that the obtained benzothiophenes can be used for further transformation to give diverse benzothiophene derivatives efficiently and selectively.