dl-1,3-propanediyl-6,6'-bis(5,6-dihydro-3,5,5-trimethyl-2-oxo-1,4-oxazinyl) | 114581-72-5

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑啉类
• 英文名称: dl-1,3-propanediyl-6,6'-bis(5,6-dihydro-3,5,5-trimethyl-2-oxo-1,4-oxazinyl)
• 英文别名: 3,3,5-trimethyl-2-[3-(3,3,5-trimethyl-6-oxo-2H-1,4-oxazin-2-yl)propyl]-2H-1,4-oxazin-6-one
• CAS: 114581-72-5
• 化学式: C₁₇H₂₆N₂O₄
• 分子量: 322.404
• InChiKey: FBWKAECVMVULRN-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.5
• 重原子数：
  23
• 可旋转键数：
  4
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.76
• 拓扑面积：
  77.3
• 氢给体数：
  0
• 氢受体数：
  6

反应信息

• 作为反应物：
  描述：

  dl-1,3-propanediyl-6,6'-bis(5,6-dihydro-3,5,5-trimethyl-2-oxo-1,4-oxazinyl) 以 异丙醇 为溶剂， 反应 18.0h， 以66%的产率得到8,9,11,11,19,20,22,22,30,31,33,33,41,42,44,44,52,53,55,55,59,59,63,63,67,67,71,71,75,75-triacontamethyl-6,17,28,39,50,56,60,64,68,72-decaoxa-10,21,32,43,54,58,62,66,70,74-decazaundecacyclo[51.2.2.25,8.29,12.216,19.220,23.227,30.231,34.238,41.242,45.249,52]pentaheptacontane-7,18,29,40,51,57,61,65,69,73-decone
  参考文献：
  名称：

  Synthesis and reactivity of captodative diradical oligomers incorporating the 3,5,5-trimethyl-2-oxomorpholin-3-yl (TM-3) unit

  摘要：

  DOI：

  10.1021/jo00248a025
• 作为产物：
  描述：

  8,9,11,11,19,20,22,22,30,31,33,33,41,42,44,44,52,53,55,55,59,59,63,63,67,67,71,71,75,75-triacontamethyl-6,17,28,39,50,56,60,64,68,72-decaoxa-10,21,32,43,54,58,62,66,70,74-decazaundecacyclo[51.2.2.25,8.29,12.216,19.220,23.227,30.231,34.238,41.242,45.249,52]pentaheptacontane-7,18,29,40,51,57,61,65,69,73-decone 生成 dl-1,3-propanediyl-6,6'-bis(5,6-dihydro-3,5,5-trimethyl-2-oxo-1,4-oxazinyl)
  参考文献：
  名称：

  BENSON, OLESTER, JR.;GAUDIANO, GIORGIO;HALTIWANGER, R. CURTIS;KOCH, TAD H+, J. ORG. CHEM., 53,(1988) N 13, 3036-3045

  摘要：

  DOI：