tert-butyl 2-benzyl-2-methyl-3-oxobutanoate | 1206850-34-1

• 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: tert-butyl 2-benzyl-2-methyl-3-oxobutanoate
• 英文别名: Tert-butyl 2-benzyl-2-methyl-3-oxobutanoate
• CAS: 1206850-34-1
• 化学式: C₁₆H₂₂O₃
• 分子量: 262.349
• InChiKey: YNIOYWGAJONWOL-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.3
• 重原子数：
  19
• 可旋转键数：
  6
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.5
• 拓扑面积：
  43.4
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  2-甲基-3-氧代丁酸叔丁酯 、 溴甲苯 在 Br^(1-)*C₆₀H₄₄F₄N⁽¹⁺⁾ 、 potassium hydroxide 作用下， 以 乙腈 为溶剂， 反应 3.0h， 以92%的产率得到tert-butyl 2-benzyl-2-methyl-3-oxobutanoate
  参考文献：
  名称：

  Catalytic asymmetric alkylation of α-cyanocarboxylates and acetoacetates using a phase-transfer catalyst

  摘要：

  The catalytic asymmetric alkylation of alpha-cyanocarboxylates and acetoacetates with an alkyl halide was performed under phase-transfer conditions to afford compounds which have a chiral quaternary carbon with up to 97% and 94% ee, respectively. As applications of this method, chiral 2-oxindole derivatives and a beta-lactam derivative were synthesized. (C) 2009 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetasy.2009.10.018

文献信息

• Catalytic asymmetric alkylation of α-cyanocarboxylates and acetoacetates using a phase-transfer catalyst
  作者：Kazuhiro Nagata、Daisuke Sano、Yu Shimizu、Michiko Miyazaki、Takuya Kanemitsu、Takashi Itoh

  DOI：10.1016/j.tetasy.2009.10.018

  日期：2009.11

  The catalytic asymmetric alkylation of alpha-cyanocarboxylates and acetoacetates with an alkyl halide was performed under phase-transfer conditions to afford compounds which have a chiral quaternary carbon with up to 97% and 94% ee, respectively. As applications of this method, chiral 2-oxindole derivatives and a beta-lactam derivative were synthesized. (C) 2009 Elsevier Ltd. All rights reserved.