N-[[3-[6-[3-(hydroxyiminomethyl)-2,4,6-trimethylphenyl]hexyl]-2,4,6-trimethylphenyl]methylidene]hydroxylamine | 136412-96-9

• 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: N-[[3-[6-[3-(hydroxyiminomethyl)-2,4,6-trimethylphenyl]hexyl]-2,4,6-trimethylphenyl]methylidene]hydroxylamine
• CAS: 136412-96-9
• 化学式: C₂₆H₃₆N₂O₂
• 分子量: 408.584
• InChiKey: RZWBDZBFQVRUCF-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  7.9
• 重原子数：
  30
• 可旋转键数：
  9
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.46
• 拓扑面积：
  65.2
• 氢给体数：
  2
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  N-[[3-[6-[3-(hydroxyiminomethyl)-2,4,6-trimethylphenyl]hexyl]-2,4,6-trimethylphenyl]methylidene]hydroxylamine 在 sodium hypochlorite 作用下， 以 二氯甲烷 为溶剂， 反应 2.0h， 以68%的产率得到2,4,6-Trimethyl-3-[6-(2,4,6-trimethyl-3-oxycyanophenyl)hexyl]benzonitrile oxide
  参考文献：
  名称：

  Synthesis and properties of stable aromatic bis(nitrile oxides)

  摘要：

  A number of stable bis(nitrile oxides) based on dimesitylmethane and didurylmethane and their analogs in which two aromatic rings are joined by various bridging groups were synthesized. The thermal isomerization of the bis(nitrile oxides) to diisocyanates and the relative reactivities of the bis(nitrile oxides) in 1,3-dipolar cycloaddition to styrene were studied.

  DOI：

  10.1007/bf00961305

文献信息

• Synthesis and properties of stable aromatic bis(nitrile oxides)
  作者：D. V. Tsyganov、A. P. Yakubov、L. I. Belen'kii、M. M. Krayushkin

  DOI：10.1007/bf00961305

  日期：1991.6

  A number of stable bis(nitrile oxides) based on dimesitylmethane and didurylmethane and their analogs in which two aromatic rings are joined by various bridging groups were synthesized. The thermal isomerization of the bis(nitrile oxides) to diisocyanates and the relative reactivities of the bis(nitrile oxides) in 1,3-dipolar cycloaddition to styrene were studied.