3-acetoxy-2-oxopropyl 2-(diethoxyphosphoryl)-2-phenylacetate | 1620136-28-8

• 分子结构分类: 有机化合物 - 有机酸及其衍生物
• 英文名称: 3-acetoxy-2-oxopropyl 2-(diethoxyphosphoryl)-2-phenylacetate
• CAS: 1620136-28-8
• 化学式: C₁₇H₂₃O₈P
• 分子量: 386.339
• InChiKey: OCDWEDZKGMYWQT-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.67
• 重原子数：
  26.0
• 可旋转键数：
  11.0
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.47
• 拓扑面积：
  105.2
• 氢给体数：
  0.0
• 氢受体数：
  8.0

反应信息

• 作为反应物：
  描述：

  3-acetoxy-2-oxopropyl 2-(diethoxyphosphoryl)-2-phenylacetate 在 甲醇 、 三溴化磷 、 三乙胺 、 乙酰氯 、 lithium hexamethyldisilazane 作用下， 以 四氢呋喃 、 乙腈 为溶剂， 反应 164.5h， 生成
  参考文献：
  名称：

  An Intramolecular [2 + 2] Photocycloaddition Approach to Conformationally Restricted Bis-Pyrrolidines

  摘要：

  With N-Boc-protected 4-(allylaminomethyl)-2-(5H)furanones as starting materials, a photochemical approach is presented to give 3,9-diazatricyclo[5.3.0.0(1,5)]decanes as conformationally restricted bis-pyrrolidines. The products are orthogonally protected at the two nitrogen atoms and exhibit, depending on the substitution pattern at positions C5, C6, and C7, latent C-2 symmetry. When the furanones had a phenyl group at the 3-position (X-3), alternative photochemical pathways were observed.

  DOI：

  10.1021/jo501302f
• 作为产物：
  描述：

  methyl 2-(diethoxyphosphoryl)-2-phenylacetate 在 四丁基碘化铵 、 三乙胺 、 potassium hydroxide 作用下， 以 乙醇 、 水 、 N,N-二甲基甲酰胺 为溶剂， 反应 8.0h， 生成 3-acetoxy-2-oxopropyl 2-(diethoxyphosphoryl)-2-phenylacetate
  参考文献：
  名称：

  An Intramolecular [2 + 2] Photocycloaddition Approach to Conformationally Restricted Bis-Pyrrolidines

  摘要：

  With N-Boc-protected 4-(allylaminomethyl)-2-(5H)furanones as starting materials, a photochemical approach is presented to give 3,9-diazatricyclo[5.3.0.0(1,5)]decanes as conformationally restricted bis-pyrrolidines. The products are orthogonally protected at the two nitrogen atoms and exhibit, depending on the substitution pattern at positions C5, C6, and C7, latent C-2 symmetry. When the furanones had a phenyl group at the 3-position (X-3), alternative photochemical pathways were observed.

  DOI：

  10.1021/jo501302f