methyl 2-[hydroxy(mesitylacetyl)amino]-4-methoxy-2-methylbutanoate | 596806-79-0

• 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: methyl 2-[hydroxy(mesitylacetyl)amino]-4-methoxy-2-methylbutanoate
• 英文别名: Methyl 2-[hydroxy-[2-(2,4,6-trimethylphenyl)acetyl]amino]-4-methoxy-2-methylbutanoate
• CAS: 596806-79-0
• 化学式: C₁₈H₂₇NO₅
• 分子量: 337.416
• InChiKey: YKNJFJHOGBLGNK-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.3
• 重原子数：
  24
• 可旋转键数：
  8
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.56
• 拓扑面积：
  76.1
• 氢给体数：
  1
• 氢受体数：
  5

反应信息

• 作为反应物：
  描述：

  methyl 2-[hydroxy(mesitylacetyl)amino]-4-methoxy-2-methylbutanoate 在 potassium tert-butylate 、 sodium hydride 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 反应 3.0h， 生成 4-Hydroxy-5-(2-methoxy-ethyl)-1-methoxymethoxy-5-methyl-3-(2,4,6-trimethyl-phenyl)-1,5-dihydro-pyrrol-2-one
  参考文献：
  名称：

  Synthesis and insecticidal activity of novel N-oxydihydropyrroles: 4-hydroxy-3-mesityl-1-methoxymethoxy derivatives with various substituents at the 5-position

  摘要：

  This paper reports the synthesis and insecticidal activity of a series of novel 4-hydroxy-3-mesityl-1-methoxymethoxy-1,5-dihydro-2H-pyrrol-2-one derivatives, in which the substituents at the 5-position were varied with a number of alkyl and spirocycloalkyl groups. Investigation of the structure-activity relationships revealed that small alkyl and spirocyclohexyl groups had a favorable effect on the insecticidal activity of these agents against Myzus persicae. (C) 2002 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0968-0896(02)00474-1
• 作为产物：
  描述：

  4-Methoxy-2-{[1-(4-methoxy-phenyl)-meth-(E)-ylidene]-amino}-2-methyl-butyric acid methyl ester 在 盐酸羟胺 、 碳酸氢钠 、 sodium carbonate 、 间氯过氧苯甲酸 作用下， 以 甲醇 、 水 、 乙酸乙酯 、 1,2-二氯乙烷 为溶剂， 反应 12.0h， 生成 methyl 2-[hydroxy(mesitylacetyl)amino]-4-methoxy-2-methylbutanoate
  参考文献：
  名称：

  Synthesis and insecticidal activity of novel N-oxydihydropyrroles: 4-hydroxy-3-mesityl-1-methoxymethoxy derivatives with various substituents at the 5-position

  摘要：

  This paper reports the synthesis and insecticidal activity of a series of novel 4-hydroxy-3-mesityl-1-methoxymethoxy-1,5-dihydro-2H-pyrrol-2-one derivatives, in which the substituents at the 5-position were varied with a number of alkyl and spirocycloalkyl groups. Investigation of the structure-activity relationships revealed that small alkyl and spirocyclohexyl groups had a favorable effect on the insecticidal activity of these agents against Myzus persicae. (C) 2002 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0968-0896(02)00474-1