N-[(Z)-(4-fluorophenyl)methylideneamino]-2-(trifluoromethyl)aniline

• 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: N-[(Z)-(4-fluorophenyl)methylideneamino]-2-(trifluoromethyl)aniline
• 化学式: C₁₄H₁₀F₄N₂
• 分子量: 282.24
• InChiKey: XQSVVRDHCRXQOP-OCKHKDLRSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.1
• 重原子数：
  20
• 可旋转键数：
  3
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.07
• 拓扑面积：
  24.4
• 氢给体数：
  1
• 氢受体数：
  6

反应信息

• 作为反应物：
  描述：

  N-[(Z)-(4-fluorophenyl)methylideneamino]-2-(trifluoromethyl)aniline 在 sodium hexamethyldisilazane 作用下， 以 四氢呋喃 为溶剂， 反应 4.0h， 以73%的产率得到4-Cinnolinamine, 3-(4-fluorophenyl)-
  参考文献：
  名称：

  A novel synthesis of 3,4-disubstituted cinnolines from o-trifluorophenyl hydrazones

  摘要：

  An efficient synthesis of 3-aryl-4-aminocinnolines from ortho-trifluoromethylphenyl hydrazones is described. The mechanism of the described transformation is likely to involve the formation of the quinone methide intermediate. The described procedure is easily adaptable to automated solid phase synthesis leading to analytically pure heterocycles. (C) 1999 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0040-4039(99)00949-1
• 作为产物：
  描述：

  对氟苯甲醛 、 2-(三氟甲基)苯基肼 以 甲苯 为溶剂， 反应 2.0h， 以87%的产率得到N-[(Z)-(4-fluorophenyl)methylideneamino]-2-(trifluoromethyl)aniline
  参考文献：
  名称：

  A novel synthesis of 3,4-disubstituted cinnolines from o-trifluorophenyl hydrazones

  摘要：

  An efficient synthesis of 3-aryl-4-aminocinnolines from ortho-trifluoromethylphenyl hydrazones is described. The mechanism of the described transformation is likely to involve the formation of the quinone methide intermediate. The described procedure is easily adaptable to automated solid phase synthesis leading to analytically pure heterocycles. (C) 1999 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0040-4039(99)00949-1

文献信息

• A novel synthesis of 3,4-disubstituted cinnolines from o-trifluorophenyl hydrazones
  作者：Alexander S. Kiselyov、Celia Dominguez

  DOI：10.1016/s0040-4039(99)00949-1

  日期：1999.7

  An efficient synthesis of 3-aryl-4-aminocinnolines from ortho-trifluoromethylphenyl hydrazones is described. The mechanism of the described transformation is likely to involve the formation of the quinone methide intermediate. The described procedure is easily adaptable to automated solid phase synthesis leading to analytically pure heterocycles. (C) 1999 Elsevier Science Ltd. All rights reserved.