3-(4-Methoxyphenyl)-6-methyl-5,6-dihydro-2H-1,2,4-oxadiazine | 919296-15-4

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯酚醚
• 英文名称: 3-(4-Methoxyphenyl)-6-methyl-5,6-dihydro-2H-1,2,4-oxadiazine
• 英文别名: 3-(4-methoxyphenyl)-6-methyl-5,6-dihydro-2H-1,2,4-oxadiazine
• CAS: 919296-15-4
• 化学式: C₁₁H₁₄N₂O₂
• 分子量: 206.244
• InChiKey: YCRPJUILLFUQJJ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.3
• 重原子数：
  15
• 可旋转键数：
  2
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.36
• 拓扑面积：
  42.8
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  3-(4-Methoxyphenyl)-6-methyl-5,6-dihydro-2H-1,2,4-oxadiazine 、 溴甲苯 在 caesium carbonate 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 生成 4-Benzyl-3-(4-methoxyphenyl)-6-methyl-5,6-dihydro-1,2,4-oxadiazine
  参考文献：
  名称：

  Scandium(III) triflate–TMSCl promoted cyclization of aziridin-1-yl oximes to 5,6-dihydro-4H-[1,2,4]oxadiazines

  摘要：

  A convenient and facile one-pot synthesis of 5,6-dihydro-4H-[1,2,4]oxadiazine is described. Treatment of aziridin-1-yl-oximes with Scandium(III) triffate readily afforded 5,6-dihydro-4H-[1,2,4]oxadiazine in the presence of chlorotrimethylsilane. (c) 2006 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2006.10.096
• 作为产物：
  描述：

  (NE)-N-[(4-methoxyphenyl)-(2-methylaziridin-1-yl)methylidene]hydroxylamine 在 三甲基氯硅烷 、 scandium tris(trifluoromethanesulfonate) 作用下， 以 二氯甲烷 为溶剂， 以81%的产率得到3-(4-Methoxyphenyl)-6-methyl-5,6-dihydro-2H-1,2,4-oxadiazine
  参考文献：
  名称：

  Scandium(III) triflate–TMSCl promoted cyclization of aziridin-1-yl oximes to 5,6-dihydro-4H-[1,2,4]oxadiazines

  摘要：

  A convenient and facile one-pot synthesis of 5,6-dihydro-4H-[1,2,4]oxadiazine is described. Treatment of aziridin-1-yl-oximes with Scandium(III) triffate readily afforded 5,6-dihydro-4H-[1,2,4]oxadiazine in the presence of chlorotrimethylsilane. (c) 2006 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2006.10.096

文献信息

• Scandium(III) triflate–TMSCl promoted cyclization of aziridin-1-yl oximes to 5,6-dihydro-4H-[1,2,4]oxadiazines
  作者：Sung Yun Cho、Seung Kyu Kang、Jin Hee Ahn、Jae Du Ha、Joong-Kwon Choi

  DOI：10.1016/j.tetlet.2006.10.096

  日期：2006.12

  A convenient and facile one-pot synthesis of 5,6-dihydro-4H-[1,2,4]oxadiazine is described. Treatment of aziridin-1-yl-oximes with Scandium(III) triffate readily afforded 5,6-dihydro-4H-[1,2,4]oxadiazine in the presence of chlorotrimethylsilane. (c) 2006 Elsevier Ltd. All rights reserved.