methyl 1-hydroxyindole-3-propionate | 161203-00-5

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吲哚及其衍生物
• 英文名称: methyl 1-hydroxyindole-3-propionate
• 英文别名: Methyl 3-(1-hydroxyindol-3-yl)propanoate
• CAS: 161203-00-5
• 化学式: C₁₂H₁₃NO₃
• 分子量: 219.24
• InChiKey: FXUKGEZCBUDVEK-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.2
• 重原子数：
  16
• 可旋转键数：
  4
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.25
• 拓扑面积：
  51.5
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  重氮甲烷 、 methyl 1-hydroxyindole-3-propionate 生成 methyl 1 -methoxyindole -3-propionate
  参考文献：
  名称：

  Simple Syntheses of Lespedamine and 5-Bromo-N,N-dimethyltryptamine Based on 1-Hydroxyindole Chemistry

  摘要：

  Various types of 1-hydroxyindoles were prepared for the first time. Through methylation or acid catalyzed nucleophilic bromination of N,N-dimethyl-1-hydroxytryptamine, simple syntheses of lespedamine and 5-bromo-N,N-dimethyltryptamine were achieved, respectively.

  DOI：

  10.3987/com-94-s26
• 作为产物：
  描述：

  methyl 3-(indolin-3-yl)propanoate 在 sodium tungstate 、 双氧水 作用下， 以 甲醇 、 水 为溶剂， 以59%的产率得到methyl 1-hydroxyindole-3-propionate
  参考文献：
  名称：

  Simple Syntheses of Lespedamine and 5-Bromo-N,N-dimethyltryptamine Based on 1-Hydroxyindole Chemistry

  摘要：

  Various types of 1-hydroxyindoles were prepared for the first time. Through methylation or acid catalyzed nucleophilic bromination of N,N-dimethyl-1-hydroxytryptamine, simple syntheses of lespedamine and 5-bromo-N,N-dimethyltryptamine were achieved, respectively.

  DOI：

  10.3987/com-94-s26

文献信息

• Hasegawa, Masakazu; Tabata, Mutsuko; Satoh, Keiichi, Heterocycles, 1996, vol. 43, # 11, p. 2333 - 2342
  作者：Hasegawa, Masakazu、Tabata, Mutsuko、Satoh, Keiichi、Yamada, Fumio、Somei, Masanori

  DOI：——

  日期：——
• JPH08151366A
  申请人：——

  公开号：JPH08151366A

  公开（公告）日：1996-06-11
• Simple Syntheses of Lespedamine and 5-Bromo-N,N-dimethyltryptamine Based on 1-Hydroxyindole Chemistry
  作者：Masanori Somei、Kensuke Kobayashi、Keiko Tanii、Toshihiko Mochizuki、Yumiko Kawada、Yashikazu Fukui

  DOI：10.3987/com-94-s26

  日期：——

  Various types of 1-hydroxyindoles were prepared for the first time. Through methylation or acid catalyzed nucleophilic bromination of N,N-dimethyl-1-hydroxytryptamine, simple syntheses of lespedamine and 5-bromo-N,N-dimethyltryptamine were achieved, respectively.