Natriumpiperonalglycidat | 57633-15-5

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 苯并间二氧杂环戊烯类
• 英文名称: Natriumpiperonalglycidat
• 英文别名: Sodium;3-(1,3-benzodioxol-5-yl)oxirane-2-carboxylate
• CAS: 57633-15-5
• 化学式: C₁₀H₇O₅*Na
• 分子量: 230.152
• InChiKey: NNABMQMXSGRRJW-UHFFFAOYSA-M

计算性质

• 辛醇/水分配系数(LogP)：
  -3.39
• 重原子数：
  16
• 可旋转键数：
  2
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.3
• 拓扑面积：
  71.1
• 氢给体数：
  0
• 氢受体数：
  5

反应信息

• 作为反应物：
  描述：

  Natriumpiperonalglycidat 在 溶剂黄146 作用下， 以 苯 为溶剂， 反应 4.0h， 以57%的产率得到胡椒基甲醛
  参考文献：
  名称：

  Synthesis of a Biochemically Important Aldehyde, 3,4-Dihydroxyphenylacetaldehyde

  摘要：

  3,4-Dihydroxyphenylacetaldehyde (DOPAL) is an important precursor of the major brain metabolites of dopamine, 3,4-dihydroxyphenylacetic acid and 4-hydroxy-3-methoxyphenylacetic acid. A new method for the synthesis of DOPAL from piperonal is described. We report for the first time the physical and chemical characteristics of DOPAL. Its importance for research in Parkinson's disease and Alzheimer's disease is discussed, (C) 1998 Academic Press.

  DOI：

  10.1006/bioo.1998.1087
• 作为产物：
  描述：

  3-benzo[1,3]dioxol-5-yl-2,3-epoxy-propionic acid ethyl ester 在 sodium hydroxide 作用下， 以81%的产率得到Natriumpiperonalglycidat
  参考文献：
  名称：

  Synthesis of a Biochemically Important Aldehyde, 3,4-Dihydroxyphenylacetaldehyde

  摘要：

  3,4-Dihydroxyphenylacetaldehyde (DOPAL) is an important precursor of the major brain metabolites of dopamine, 3,4-dihydroxyphenylacetic acid and 4-hydroxy-3-methoxyphenylacetic acid. A new method for the synthesis of DOPAL from piperonal is described. We report for the first time the physical and chemical characteristics of DOPAL. Its importance for research in Parkinson's disease and Alzheimer's disease is discussed, (C) 1998 Academic Press.

  DOI：

  10.1006/bioo.1998.1087