1-tert-butyl-5-(isopropoxy(naphthalen-2-yl)methyl)-1H-tetrazole | 1380490-11-8

• 分子结构分类: 有机化合物 - 苯类化合物 - 萘
• 英文名称: 1-tert-butyl-5-(isopropoxy(naphthalen-2-yl)methyl)-1H-tetrazole
• 英文别名: 1-Tert-butyl-5-[naphthalen-2-yl(propan-2-yloxy)methyl]tetrazole；1-tert-butyl-5-[naphthalen-2-yl(propan-2-yloxy)methyl]tetrazole
• CAS: 1380490-11-8
• 化学式: C₁₉H₂₄N₄O
• 分子量: 324.426
• InChiKey: MNFWJBDZSKVBEL-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.9
• 重原子数：
  24
• 可旋转键数：
  5
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.42
• 拓扑面积：
  52.8
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  异氰酸叔丁酯 、 2-萘甲醛 、 异丙醇 在 indium(III) triflate 、 叠氮基三甲基硅烷 、 原甲酸三甲酯 作用下， 反应 4.0h， 以72%的产率得到1-tert-butyl-5-(isopropoxy(naphthalen-2-yl)methyl)-1H-tetrazole
  参考文献：
  名称：

  Four component reaction of aldehydes, isocyanides, Me3SiN3, and aliphatic alcohols catalyzed by indium triflate

  摘要：

  In the presence of catalytic amount of indium(III) Lewis acids, the four component reaction of aldehydes, isocyanides, trimethylsilyl azide and aliphatic alcohols smoothly proceeded to give alkoxylated 1H-tetrazole products in good yields. In particular, In(OTf)(3) and In(ONf)(3) showed notably high level of catalytic activity in this reaction. (C) 2012 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2012.04.046

文献信息

• Four component reaction of aldehydes, isocyanides, Me3SiN3, and aliphatic alcohols catalyzed by indium triflate
  作者：Hikaru Yanai、Takuji Sakiyama、Tomoko Oguchi、Takeo Taguchi

  DOI：10.1016/j.tetlet.2012.04.046

  日期：2012.6

  In the presence of catalytic amount of indium(III) Lewis acids, the four component reaction of aldehydes, isocyanides, trimethylsilyl azide and aliphatic alcohols smoothly proceeded to give alkoxylated 1H-tetrazole products in good yields. In particular, In(OTf)(3) and In(ONf)(3) showed notably high level of catalytic activity in this reaction. (C) 2012 Elsevier Ltd. All rights reserved.