3-Methylbutyl 2-(methylamino)acetate | 1248283-80-8

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 羧酸及其衍生物
• 英文名称: 3-Methylbutyl 2-(methylamino)acetate
• CAS: 1248283-80-8
• 化学式: C₈H₁₇NO₂
• 分子量: 159.228
• InChiKey: MIIYTSRYVZEAJP-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.4
• 重原子数：
  11
• 可旋转键数：
  6
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.88
• 拓扑面积：
  38.3
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  3-Methylbutyl 2-(methylamino)acetate 在 碘 、 1,8-二氮杂双环[5.4.0]十一碳-7-烯 作用下， 以 5,5-dimethyl-1,3-cyclohexadiene 为溶剂， 反应 1.0h， 生成
  参考文献：
  名称：

  The Synthesis of Benzo[f]isoindole-1,3-dicarboxylates via an I₂-Induced 1,3-Dipolar Cycloaddition Reaction

  摘要：

  An I-2-induced 1,3-dipolar cycloaddition reaction has been developed for the synthesis of benzo[f]-isoindole-1,3-dicarboxylates from quinones and N-substituted amino esters. The reaction proceeds in good to excellent yields in one step from 3 equiv of amino ester to react with the quinone structure. The utility of this transformation has been highlighted by its use for the construction of benzo[f]-isoindole-1,3-dicarboxylates, which have been identified in natural products exhibiting important biological activities.

  DOI：

  10.1021/jo401652k

文献信息

• Iodine mediated reaction of quinones and N-substituted amino esters to 2-substituted benzo[f]isoindole-4,9-diones
  作者：Yu-jin Li、Huan-ming Huang、Jie Ju、Jian-hong Jia、Liang Han、Qing Ye、Wu-bin Yu、Jian-rong Gao

  DOI：10.1039/c3ra44095h

  日期：——

  A novel and efficient synthesis of benzo[f]isoindole-4,9-diones through the I2-promoted cyclization reaction of N-substituted amino acid esters and quinones has been realized successfully via an unprecedented 1,3-dipolar cycloaddition using KF as the base. Different substituted amino esters were found able to react with quinones through a cycloaddition reaction to afford 2-substituted benzo[f]isoindole-4

  苯并[一种新颖和有效的合成˚F ]通过I异吲哚-4,9-二酮2的促进的环化反应Ñ取代的氨基酸酯和醌已经成功地实现了通过使用KF作为一个前所未有的1,3-偶极环加成基地。发现不同的取代的氨基酯能够通过环加成反应与醌反应，得到2-取代的苯并[ f ]异吲哚-4，9-二酮。这些令人感兴趣的化合物的出人意料的，短暂的，有吸引力的和直接的合成是重要和相关的，并且为合成2-取代的苯并[ f ]异吲哚-4,9-二酮提供了极其优选的方法。