3-(Furan-2-yl)-4-methylbenzaldehyde | 362052-26-4

• 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: 3-(Furan-2-yl)-4-methylbenzaldehyde
• 英文别名: 3-(furan-2-yl)-4-methylbenzaldehyde
• CAS: 362052-26-4
• 化学式: C₁₂H₁₀O₂
• 分子量: 186.21
• InChiKey: DYQQPNRUCPOHOO-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.5
• 重原子数：
  14
• 可旋转键数：
  2
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.08
• 拓扑面积：
  30.2
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  3-(Furan-2-yl)-4-methylbenzaldehyde 在 Yb(CF₃CO₃)3 、 三乙酰氧基硼氢化钠 、 溶剂黄146 作用下， 以 1,2-二氯乙烷 、 乙腈 为溶剂， 反应 2.0h， 生成 1,1,1-Trifluoro-3-((3-(furan-2-yl)-4-methylbenzyl)(3-phenoxyphenyl)amino)propan-2-ol
  参考文献：
  名称：

  Novel heteroaryl replacements of aromatic 3-tetrafluoroethoxy substituents in trifluoro-3-(tertiaryamino)-2-propanols as potent inhibitors of cholesteryl ester transfer protein

  摘要：

  A series of novel N,N-desubstituted trifluoro-3-amino-2-propanols has been prepared as potent inhibitors of cholesteryl ester transfer protein (CETP). Modifying the aromatic 3-tetrafluoroethoxy group in the lead molecule la with various heteroaryl moieties produced new 2-furyl analogues 2a.b with submicromolar potency in vitro. (C) 2001 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0960-894x(01)00244-x
• 作为产物：
  描述：

  3-溴-4-甲基苯甲醛 、 2-(三丁基锡烷基)呋喃 在 bis-triphenylphosphine-palladium(II) chloride 作用下， 以 1,4-二氧六环 为溶剂， 反应 18.0h， 生成 3-(Furan-2-yl)-4-methylbenzaldehyde
  参考文献：
  名称：

  Novel heteroaryl replacements of aromatic 3-tetrafluoroethoxy substituents in trifluoro-3-(tertiaryamino)-2-propanols as potent inhibitors of cholesteryl ester transfer protein

  摘要：

  A series of novel N,N-desubstituted trifluoro-3-amino-2-propanols has been prepared as potent inhibitors of cholesteryl ester transfer protein (CETP). Modifying the aromatic 3-tetrafluoroethoxy group in the lead molecule la with various heteroaryl moieties produced new 2-furyl analogues 2a.b with submicromolar potency in vitro. (C) 2001 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0960-894x(01)00244-x

文献信息

• Novel heteroaryl replacements of aromatic 3-tetrafluoroethoxy substituents in trifluoro-3-(tertiaryamino)-2-propanols as potent inhibitors of cholesteryl ester transfer protein
  作者：Mark A. Massa、Dale P. Spangler、Richard C. Durley、Brian S. Hickory、Daniel T. Connolly、Bryan J. Witherbee、Mark E. Smith、James A. Sikorski

  DOI：10.1016/s0960-894x(01)00244-x

  日期：2001.7

  A series of novel N,N-desubstituted trifluoro-3-amino-2-propanols has been prepared as potent inhibitors of cholesteryl ester transfer protein (CETP). Modifying the aromatic 3-tetrafluoroethoxy group in the lead molecule la with various heteroaryl moieties produced new 2-furyl analogues 2a.b with submicromolar potency in vitro. (C) 2001 Elsevier Science Ltd. All rights reserved.