2-[Hydroxy-(2-nitro-phenyl)-methyl]-4-methyl-4-nitro-pentanoic acid methyl ester | 778583-91-8

• 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: 2-[Hydroxy-(2-nitro-phenyl)-methyl]-4-methyl-4-nitro-pentanoic acid methyl ester
• CAS: 778583-91-8
• 化学式: C₁₄H₁₈N₂O₇
• 分子量: 326.306
• InChiKey: VDWNPTWLAPZRGJ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.86
• 重原子数：
  23.0
• 可旋转键数：
  7.0
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.5
• 拓扑面积：
  132.81
• 氢给体数：
  1.0
• 氢受体数：
  7.0

反应信息

• 作为反应物：
  描述：

  2-[(4-bromo-phenyl)-hydroxy-methyl]-acrylic acid methyl ester 、 2-[Hydroxy-(2-nitro-phenyl)-methyl]-4-methyl-4-nitro-pentanoic acid methyl ester 以 四氢呋喃 为溶剂， 生成
  参考文献：
  名称：

  One-pot sequential Baylis–Hillman and Michael reactions

  摘要：

  A new one-pot procedure for the sequential Baylis-Hillman and Michael reactions has been developed to construct two carbon-carbon bonds with three components. This procedure has been applied to combine a variety of aromatic aldehydes, beta-unsubstituted acrylates and activated methide nucleophiles to generate highly diversified and functionalized organic compounds. (C) 2004 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2004.07.122
• 作为产物：
  描述：

  邻硝基苯甲醛 在 1,8-二氮杂双环[5.4.0]十一碳-7-烯 作用下， 以 四氢呋喃 为溶剂， 生成 2-[Hydroxy-(2-nitro-phenyl)-methyl]-4-methyl-4-nitro-pentanoic acid methyl ester
  参考文献：
  名称：

  One-pot sequential Baylis–Hillman and Michael reactions

  摘要：

  A new one-pot procedure for the sequential Baylis-Hillman and Michael reactions has been developed to construct two carbon-carbon bonds with three components. This procedure has been applied to combine a variety of aromatic aldehydes, beta-unsubstituted acrylates and activated methide nucleophiles to generate highly diversified and functionalized organic compounds. (C) 2004 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2004.07.122