N,N-diethyl-1-(N,N-diethylcarbamyloxy)-3-allyl-6-methoxynaphthalene-2-carboxamide | 530101-45-2

• 分子结构分类: 有机化合物 - 苯类化合物 - 萘
• 英文名称: N,N-diethyl-1-(N,N-diethylcarbamyloxy)-3-allyl-6-methoxynaphthalene-2-carboxamide
• 英文别名: [2-(diethylcarbamoyl)-6-methoxy-3-prop-2-enylnaphthalen-1-yl] N,N-diethylcarbamate
• CAS: 530101-45-2
• 化学式: C₂₄H₃₂N₂O₄
• 分子量: 412.529
• InChiKey: ZUHXRILYDBEWPV-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.9
• 重原子数：
  30
• 可旋转键数：
  10
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.42
• 拓扑面积：
  59.1
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  N,N-diethyl-1-(N,N-diethylcarbamyloxy)-3-allyl-6-methoxynaphthalene-2-carboxamide 在 盐酸 作用下， 以 水 为溶剂， 反应 55.0h， 生成
  参考文献：
  名称：

  Application of directed metallation in synthesis. Part 3: Studies in the synthesis of (±)-semivioxanthin and its analogues

  摘要：

  The synthesis of several analogues of (+/-)-semivioxanthin including five thiophene analogues, using directed metalation are reported. The strategy consisted of the synthesis of functionalized naphthalene or benzo[b]thiophene as building blocks followed by annelation of the pyrone. (C) 2003 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0040-4020(02)01599-5
• 作为产物：
  描述：

  N,N-diethyl-1-carbamyloxy-6-methoxynaphthalene 在 仲丁基锂 、 四亚甲基二胺 作用下， 以 四氢呋喃 为溶剂， 反应 14.0h， 生成 N,N-diethyl-1-(N,N-diethylcarbamyloxy)-3-allyl-6-methoxynaphthalene-2-carboxamide
  参考文献：
  名称：

  Application of directed metallation in synthesis. Part 3: Studies in the synthesis of (±)-semivioxanthin and its analogues

  摘要：

  The synthesis of several analogues of (+/-)-semivioxanthin including five thiophene analogues, using directed metalation are reported. The strategy consisted of the synthesis of functionalized naphthalene or benzo[b]thiophene as building blocks followed by annelation of the pyrone. (C) 2003 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0040-4020(02)01599-5