3-Acetyl-2,4,6-trimethyl-benzaldehyde oxime | 135802-56-1

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 3-Acetyl-2,4,6-trimethyl-benzaldehyde oxime
• CAS: 135802-56-1
• 化学式: C₁₂H₁₅NO₂
• 分子量: 205.257
• InChiKey: YWEZDCONDAQIMF-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.62
• 重原子数：
  15.0
• 可旋转键数：
  2.0
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.33
• 拓扑面积：
  49.66
• 氢给体数：
  1.0
• 氢受体数：
  3.0

反应信息

• 作为反应物：
  描述：

  3-Acetyl-2,4,6-trimethyl-benzaldehyde oxime 在 sodium hydroxide 、 sodium hypochlorite 作用下， 以 二氯甲烷 为溶剂， 反应 1.0h， 以55%的产率得到3-Acetyl-2,4,6-trimethyl-benzonitrile N-oxide
  参考文献：
  名称：

  Synthesis of stable functionally substituted nitrile oxides of the aromatic series

  摘要：

  Stable functionally substituted mononitrile oxides were obtained from the previously obtained sterically hindered aldehydes of the mesitylene series. The previously unknown bisnitrile oxide was also synthesized from triethylbenzene; the compound is an effective crosslinking agent. The synthesis was carried out via the stage of oximation and oxidation of the oxime by sodium hypochlorite.

  DOI：

  10.1007/bf00961380
• 作为产物：
  描述：

  3-乙酰基-2,4,6-三甲基苯甲醛 在 sodium hydroxide 、 盐酸羟胺 作用下， 以 乙醇 、 水 为溶剂， 反应 4.0h， 以81%的产率得到3-Acetyl-2,4,6-trimethyl-benzaldehyde oxime
  参考文献：
  名称：

  Synthesis of stable functionally substituted nitrile oxides of the aromatic series

  摘要：

  Stable functionally substituted mononitrile oxides were obtained from the previously obtained sterically hindered aldehydes of the mesitylene series. The previously unknown bisnitrile oxide was also synthesized from triethylbenzene; the compound is an effective crosslinking agent. The synthesis was carried out via the stage of oximation and oxidation of the oxime by sodium hypochlorite.

  DOI：

  10.1007/bf00961380