dimethyl 2,2′-(1,4-phenylenebis(azanediyl))dibenzoate

• 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: dimethyl 2,2′-(1,4-phenylenebis(azanediyl))dibenzoate
• 英文别名: Methyl 2-[4-(2-methoxycarbonylanilino)anilino]benzoate
• 化学式: C₂₂H₂₀N₂O₄
• 分子量: 376.412
• InChiKey: BBYRLODKNULKAJ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.7
• 重原子数：
  28
• 可旋转键数：
  8
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.09
• 拓扑面积：
  76.7
• 氢给体数：
  2
• 氢受体数：
  6

反应信息

• 作为反应物：
  描述：

  dimethyl 2,2′-(1,4-phenylenebis(azanediyl))dibenzoate 在 甲烷磺酸 作用下， 反应 16.0h， 以85%的产率得到cis-quinacridone
  参考文献：
  名称：

  通过角顺式-喹in啶酮获得邻苯二甲酰肼衍生物

  摘要：

  联氨基苯甲酸酯的分子内亲电环化得到有角度的顺式-喹one啶酮化合物，其与肼缩合得到酞嗪衍生物。当与乙炔二羧酸二甲酯反应时，[2 + 2 + 2]环化反应发生在酞嗪的C–N双键位置。这些新化合物的结构通过晶体学分析证实。酞嗪衍生物在黑暗中于环境条件下分解为喹ac啶酮，为固体，半衰期约为22个月。

  DOI：

  10.1021/acs.joc.0c02344

文献信息

• COMPOUND, METHOD FOR PRODUCING THE SAME, INK COMPOSITION USING THE COMPOUND, THIN FILM, ORGANIC TRANSISTOR, AND ORGANIC ELECTROLUMINESCENT DEVICE
  申请人：Sumitomo Chemical Company, Limited

  公开号：EP2180013A1

  公开（公告）日：2010-04-28

  A compound comprises a structure represented by the following general formula (1) (including a structure of a residue obtained by removing at least one hydrogen atom from the structure represented by the following general formula (1)) (in the formula (1), a ring A, a ring B and a ring C each independently represent any one of a monocyclic aromatic ring and fused aromatic ring; R1 and R4 each independently represent a monovalent group; and R2, R3, R5 and R6 each independently represent any one of a hydrogen atom, alkyl group, aryl group, arylalkyl group, alkenyl group, and alkynyl group).

  一种化合物包含以下通式（1）所表示的结构（包括从以下通式（1）所表示的结构中去除至少一个氢原子而得到的残余物的结构） (在式 (1) 中，环 A、环 B 和环 C 各自独立地代表单环芳香环和融合芳香环中的任一种；R1 和 R4 各自独立地代表单价基团；以及 R2、R3、R5 和 R6 各自独立地代表氢原子、烷基、芳基、芳烷基、烯基和炔基中的任一种）。
• COMPOUND AND METHOD FOR PRODUCING THE SAME, AND INK COMPOSITION, THIN FILM, ORGANIC TRANSISTOR AND ORGANIC ELECTROLUMINESCENCE DEVICE, EACH USING THE SAME
  申请人：Kobayashi Satoshi

  公开号：US20100201259A1

  公开（公告）日：2010-08-12

  A compound comprises a structure represented by the following general formula (1) (including a structure of a residue obtained by removing at least one hydrogen atom from the structure represented by the following general formula (1)) (in the formula (1), a ring A, a ring B and a ring C each independently represent any one of a monocyclic aromatic ring and fused aromatic ring; R 1 and R 4 each independently represent a monovalent group; and R 2 , R 3 , R 5 and R 6 each independently represent any one of a hydrogen atom, alkyl group, aryl group, arylalkyl group, alkenyl group, and alkynyl group).
• Access to a Phthalazine Derivative Through an Angular <i>cis</i>-Quinacridone
  作者：Guanxing Zhu、Gang Zhang

  DOI：10.1021/acs.joc.0c02344

  日期：2021.1.1

  angular cis-quinacridone compound, which condensed with hydrazine to give a phthalazine derivative. A [2+2+2] cyclization reaction occurred at the C–N double bond position of phthalazine when reacted with dimethyl acetylenedicarboxylate. The structures of these novel compounds were confirmed by crystallographic analysis. The phthalazine derivative decomposes back to quinacridone at ambient condition in the

  联氨基苯甲酸酯的分子内亲电环化得到有角度的顺式-喹one啶酮化合物，其与肼缩合得到酞嗪衍生物。当与乙炔二羧酸二甲酯反应时，[2 + 2 + 2]环化反应发生在酞嗪的C–N双键位置。这些新化合物的结构通过晶体学分析证实。酞嗪衍生物在黑暗中于环境条件下分解为喹ac啶酮，为固体，半衰期约为22个月。