N'-t-butyl-N-(4-ethylbenzoyl)-N'-(3-toluoyl)hydrazine | 112427-30-2

• 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'-t-butyl-N-(4-ethylbenzoyl)-N'-(3-toluoyl)hydrazine
• 英文别名: N'-t-butyl-N-(4-ethylbenzoyl)-N'-(3-methylbenzoyl)hydrazine；N-tert-butyl-N'-(4-ethylbenzoyl)-3-methylbenzohydrazide
• CAS: 112427-30-2
• 化学式: C₂₁H₂₆N₂O₂
• 分子量: 338.45
• InChiKey: ROOHEXHLQOEYFN-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.5
• 重原子数：
  25
• 可旋转键数：
  4
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.33
• 拓扑面积：
  49.4
• 氢给体数：
  1
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  溴乙酸乙酯 、 N'-t-butyl-N-(4-ethylbenzoyl)-N'-(3-toluoyl)hydrazine 在 sodium hydride 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 反应 12.0h， 以60%的产率得到[N'-tert-Butyl-N-(4-ethyl-benzoyl)-N'-(3-methyl-benzoyl)-hydrazino]-acetic acid ethyl ester
  参考文献：
  名称：

  <i>N</i>'-<i>tert</i>-Butyl-<i>N</i>'-aroyl-<i>N</i>-(alko×ycarbonylmethyl)-<i>N</i>-aroylhydrazines, a novel nonsteroidal ecdysone agonist: syntheses, insecticidal activity, conformational, and crystal structure analysis

  摘要：

  Seventeen N'-tert-butyl-N'-aroyl-N-(alkoxycarbonylmethyl)-N-aroylhydrazines were synthesized, and their insecticidal activities against armyworm (Leucania separata (Walker)) were tested. The conformation and structure of compound 1b was studied by H-1 NMR spectroscopy and X-ray crystallography. The crystal structure belongs to the orthorhombic system and the N-N bond adopts a gauche conformation, which was assumed to be the active conformation, with a dihedral angle of 69.9 degrees.

  DOI：

  10.1139/cjc-79-3-272
• 作为产物：
  描述：

  对乙基苯甲酰氯 、 N'-t-butyl-N'-(3-methylbenzoyl)hydrazine 在 sodium hydroxide 作用下， 以 二氯甲烷 、 水 为溶剂， 生成 N'-t-butyl-N-(4-ethylbenzoyl)-N'-(3-toluoyl)hydrazine
  参考文献：
  名称：

  <i>N</i>'-<i>tert</i>-Butyl-<i>N</i>'-aroyl-<i>N</i>-(alko×ycarbonylmethyl)-<i>N</i>-aroylhydrazines, a novel nonsteroidal ecdysone agonist: syntheses, insecticidal activity, conformational, and crystal structure analysis

  摘要：

  Seventeen N'-tert-butyl-N'-aroyl-N-(alkoxycarbonylmethyl)-N-aroylhydrazines were synthesized, and their insecticidal activities against armyworm (Leucania separata (Walker)) were tested. The conformation and structure of compound 1b was studied by H-1 NMR spectroscopy and X-ray crystallography. The crystal structure belongs to the orthorhombic system and the N-N bond adopts a gauche conformation, which was assumed to be the active conformation, with a dihedral angle of 69.9 degrees.

  DOI：

  10.1139/cjc-79-3-272

文献信息

• Insecticidal N'-substituted-N,N'-diacylhydrazines
  申请人：ROHM AND HAAS COMPANY

  公开号：EP0236618A2

  公开（公告）日：1987-09-16

  This invention is concerned with insecticidal compositions containing N'-substituted-N,N'-diacylhydrazines, methods of using such compositions and with certain of the insecticidal N'-substituted-N,N'-diacylhydrazines which are novel compounds.

  本发明涉及含有 N'-取代-N,N'-二乙酰肼的杀虫组合物、使用此类组合物的方法以及某些杀虫 N'-取代-N,N'-二乙酰肼的新型化合物。
• Preparation of 1,2-diacyl-2-(t-alkyl)hydrazines
  申请人：ROHM AND HAAS COMPANY

  公开号：EP0639559B1

  公开（公告）日：1997-10-15
• US4985461A
  申请人：——

  公开号：US4985461A

  公开（公告）日：1991-01-15
• &lt;i&gt;N&lt;/i&gt;'-&lt;i&gt;tert&lt;/i&gt;-Butyl-&lt;i&gt;N&lt;/i&gt;'-aroyl-&lt;i&gt;N&lt;/i&gt;-(alko×ycarbonylmethyl)-&lt;i&gt;N&lt;/i&gt;-aroylhydrazines, a novel nonsteroidal ecdysone agonist: syntheses, insecticidal activity, conformational, and crystal structure analysis
  作者：S. Cao、X. Qian、G. Song

  DOI：10.1139/cjc-79-3-272

  日期：——

  Seventeen N'-tert-butyl-N'-aroyl-N-(alkoxycarbonylmethyl)-N-aroylhydrazines were synthesized, and their insecticidal activities against armyworm (Leucania separata (Walker)) were tested. The conformation and structure of compound 1b was studied by H-1 NMR spectroscopy and X-ray crystallography. The crystal structure belongs to the orthorhombic system and the N-N bond adopts a gauche conformation, which was assumed to be the active conformation, with a dihedral angle of 69.9 degrees.