8,9,10,11-tetrahydro-7H-12-oxa-6a-azoniacyclonona[de]naphthalene bromide | 1026668-10-9

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 喹啉及其衍生物
• 英文名称: 8,9,10,11-tetrahydro-7H-12-oxa-6a-azoniacyclonona[de]naphthalene bromide
• CAS: 1026668-10-9
• 化学式: Br*C₁₄H₁₆NO
• 分子量: 294.191
• InChiKey: QGGCOSRSBMJOTB-UHFFFAOYSA-M

计算性质

• 辛醇/水分配系数(LogP)：
  -0.31
• 重原子数：
  17.0
• 可旋转键数：
  0.0
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.36
• 拓扑面积：
  13.11
• 氢给体数：
  0.0
• 氢受体数：
  1.0

反应信息

• 作为产物：
  描述：

  8-羟基喹啉 、 1,5-二溴戊烷 在 sodium hydroxide 、 四丁基溴化铵 作用下， 以 二氯甲烷 、 水 为溶剂， 反应 72.0h， 以5%的产率得到8,9,10,11-tetrahydro-7H-12-oxa-6a-azoniacyclonona[de]naphthalene bromide
  参考文献：
  名称：

  Facile synthesis of seven to nine-membered-fused tricyclic quinolones and quinolinium salts under phase transfer catalyzed conditions

  摘要：

  Phase transfer catalyzed one-pot syntheses of fused oxazepino, oxazocino, and oxazonino quinolinium cations and quinolones were achieved from 8-hydroxy quinoline derivatives with 1,omega-dihaloalkanes. Structures of all the products were elucidated by spectroscopic analysis. Single crystal X-ray crystallographic analysis of three compounds and graphical superposition of the structures indicate that products having seven-membered ring are less planar compared to the product having eight-membered ring. (c) 2008 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tet.2008.02.048