ethyl 6-(2,2-diphenyl-vinyloxymethyl)-nicotinate | 749884-58-0

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: ethyl 6-(2,2-diphenyl-vinyloxymethyl)-nicotinate
• 英文别名: Ethyl 6-(2,2-diphenylethenoxymethyl)pyridine-3-carboxylate
• CAS: 749884-58-0
• 化学式: C₂₃H₂₁NO₃
• 分子量: 359.425
• InChiKey: SQKODQOOWMNQFU-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.9
• 重原子数：
  27
• 可旋转键数：
  8
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.13
• 拓扑面积：
  48.4
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  ethyl 6-(2,2-diphenyl-vinyloxymethyl)-nicotinate 在 sodium hydroxide 、 sodium cyanoborohydride 作用下， 以 四氢呋喃 、 水 、 溶剂黄146 为溶剂， 反应 3.0h， 生成 trans-6-(2,2-diphenyl-vinyloxymethyl)-nipecotic acid hydrochloride
  参考文献：
  名称：

  Syntheses and GABA uptake properties of 6-ether- and 6-enol ether-substituted nipecotic acids

  摘要：

  6-Aralkylether- and 6-arylenol-ether-substituted nipecotic acids were synthesized. These analogues are poor GABA uptake inhibitors. The electronegative region concept developed in the N-substituted nipecotic acid series cannot be transferred on the side chain of this series of 6-substitued analogues. (C) 2004 Elsevier SAS. All rights reserved.

  DOI：

  10.1016/j.ejmech.2004.03.006
• 作为产物：
  描述：

  6-(羟基甲基)烟酸乙酯 在 四氯化碳 、 三丁基膦 、 sodium hydride 作用下， 以 乙腈 为溶剂， 反应 2.75h， 生成 ethyl 6-(2,2-diphenyl-vinyloxymethyl)-nicotinate
  参考文献：
  名称：

  Syntheses and GABA uptake properties of 6-ether- and 6-enol ether-substituted nipecotic acids

  摘要：

  6-Aralkylether- and 6-arylenol-ether-substituted nipecotic acids were synthesized. These analogues are poor GABA uptake inhibitors. The electronegative region concept developed in the N-substituted nipecotic acid series cannot be transferred on the side chain of this series of 6-substitued analogues. (C) 2004 Elsevier SAS. All rights reserved.

  DOI：

  10.1016/j.ejmech.2004.03.006

文献信息

• Syntheses and GABA uptake properties of 6-ether- and 6-enol ether-substituted nipecotic acids
  作者：Victor N’Goka、Caterina Bissantz、Philippe Bisel、Tine B. Stenbøl、Povl Krogsgaard-Larsen、Gilbert Schlewer

  DOI：10.1016/j.ejmech.2004.03.006

  日期：2004.7

  6-Aralkylether- and 6-arylenol-ether-substituted nipecotic acids were synthesized. These analogues are poor GABA uptake inhibitors. The electronegative region concept developed in the N-substituted nipecotic acid series cannot be transferred on the side chain of this series of 6-substitued analogues. (C) 2004 Elsevier SAS. All rights reserved.