9H-Pyrido(3,4-b)indole, 1,2,3,4-tetrahydro-1-(o-chlorophenyl)-, hydrochloride | 3380-79-8

• 分子结构分类: 有机化合物 - 生物碱及其衍生物 - 哈马拉生物碱
• 英文名称: 9H-Pyrido(3,4-b)indole, 1,2,3,4-tetrahydro-1-(o-chlorophenyl)-, hydrochloride
• 英文别名: 1-(2-chlorophenyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole;hydrochloride
• CAS: 3380-79-8
• 化学式: C₁₇H₁₅ClN₂*ClH
• 分子量: 319.233
• InChiKey: BXFHINAHGVDUKU-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.48
• 重原子数：
  21
• 可旋转键数：
  1
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.18
• 拓扑面积：
  27.8
• 氢给体数：
  3
• 氢受体数：
  1

反应信息

• 作为产物：
  描述：

  色胺盐酸盐 、 2-氯苯甲醛 反应 0.05h， 以92%的产率得到9H-Pyrido(3,4-b)indole, 1,2,3,4-tetrahydro-1-(o-chlorophenyl)-, hydrochloride
  参考文献：
  名称：

  Microwave‐Assisted One‐Pot Preparation of Tetrahydro‐β‐carboline Hydrochlorides under Solvent‐Free Conditions

  摘要：

  An efficient and environmentally friendly synthesis of tetrahydro-beta-carboline hydrochlorides via Pictet-Spengler reaction was described. Tryptamine hydrochlorides were used as the reactant and no additional acid catalyst was needed. This reaction was completed within 2.5-9 min in good yield.

  DOI：

  10.1080/00397910701572555

文献信息

• Microwave‐Assisted One‐Pot Preparation of Tetrahydro‐β‐carboline Hydrochlorides under Solvent‐Free Conditions
  作者：Fei Liu、Qi‐Dong You

  DOI：10.1080/00397910701572555

  日期：2007.11

  An efficient and environmentally friendly synthesis of tetrahydro-beta-carboline hydrochlorides via Pictet-Spengler reaction was described. Tryptamine hydrochlorides were used as the reactant and no additional acid catalyst was needed. This reaction was completed within 2.5-9 min in good yield.