3-(2,4-bis-diethylamino-phenyl)-4,5,6,7-tetrachloro-3-(1-ethyl-2-methyl-indol-3-yl)-3H-isobenzofuran-1-one | 68470-07-5

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 苯并呋喃
• 英文名称: 3-(2,4-bis-diethylamino-phenyl)-4,5,6,7-tetrachloro-3-(1-ethyl-2-methyl-indol-3-yl)-3H-isobenzofuran-1-one
• 英文别名: 3-[2,4-Bis(diethylamino)phenyl]-3-(1-ethyl-2-methyl-3-indolyl)4,5,6,7-tetrachlorophthalide；3-[2,4-bis(diethylamino)phenyl]-4,5,6,7-tetrachloro-3-(1-ethyl-2-methylindol-3-yl)-2-benzofuran-1-one
• CAS: 68470-07-5
• 化学式: C₃₃H₃₅Cl₄N₃O₂
• 分子量: 647.472
• InChiKey: CQBFUEKSODIDTI-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  9.5
• 重原子数：
  42
• 可旋转键数：
  9
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.36
• 拓扑面积：
  37.7
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  (1-ethyl-2-methylindol-3-yl)-(2-carboxy-3,4,5,6-tetrachlorophenyl)ketone 、 N,N,N',N'-Tetraethyl-m-phenylendiamin 以 乙酸酐 为溶剂， 以to obtain 3-[2,4-bis(diethylamino)phenyl]-3-(1-ethyl-2-methyl-3-indolyl)-4,5,6,7-tetrachlorophthalide (Formula III的产率得到3-(2,4-bis-diethylamino-phenyl)-4,5,6,7-tetrachloro-3-(1-ethyl-2-methyl-indol-3-yl)-3H-isobenzofuran-1-one
  参考文献：
  名称：

  Marking systems containing 3-aryl-3-heterylphthalides and

  摘要：

  通过适当的2-(杂环芳基)羧酸苯和适当的苯胺之间的相互作用制备的3-Aryl-3-indolylphthalides、3-aryl-3-pyrrolylphthalides和3-aryl-3-carbazolylphthalides，以及通过适当的2-(吲哚基)羧酸苯和适当的吲哚之间的相互作用制备的3,3-双(吲哚基)邻苯二甲酸酯，在压敏无碳复写系统、热标记系统和电写复印系统中作为显色剂有用。

  公开号：

  US04189171A1

文献信息

• Phthalide compounds, processes and marking systems
  申请人：Sterling Drug Inc.

  公开号：US04251446A1

  公开（公告）日：1981-02-17

  3-Aryl-3-indolylphthalides, 3-aryl-3-pyrrolylphthalides and 3-aryl-3-carbazolylphthalides prepared by interaction of the appropriate 2-(heteroaryl)carbonylbenzoic acid and the appropriate phenylamine, and 3,3-bis(indolyl)phthalides prepared by the interaction of the appropriate 2-(indolyl)carbonylbenzoic acid and the appropriate indole are useful as color formers in pressure-sensitive carbonless duplicating systems, thermal marking systems and hectographic copying systems.

  3-芳基-3-吲哚基酞酮、3-芳基-3-吡咯基酞酮和3-芳基-3-咔唑基酞酮是通过适当的2-(杂环芳基)羰基苯甲酸和适当的苯胺相互作用制备的，而3,3-双(吲哚基)酞酮则是通过适当的2-(吲哚基)羰基苯甲酸和适当的吲哚相互作用制备的。它们在压敏无碳复写系统、热标记系统和铜版复印系统中作为色形成剂是有用的。
• Indolyl phthalide compounds
  申请人：Sterling Drug Inc.

  公开号：US04322352A1

  公开（公告）日：1982-03-30

  3-Aryl-3-indolylphthalides, 3-aryl-3-pyrrolylphthalides and 3-aryl-3-carbazolylphthalides prepared by interaction of the appropriate 2-(heteroaryl)carbonylbenzoic acid and the appropriate phenylamine, and 3,3-bis(indolyl)phthalides prepared by the interaction of the appropriate 2-(indolyl)carbonylbenzoic acid and the appropriate indole are useful as color formers in pressure-sensitive carbonless duplicating systems, thermal marking systems and hectographic copying systems.

  通过适当的2-(杂环芳基)羧基苯甲酸和适当的苯胺的反应制备的3-芳基-3-吲哚基邻苯二甲酸酯，3-芳基-3-吡咯基邻苯二甲酸酯和3-芳基-3-咔唑基邻苯二甲酸酯，以及通过适当的2-(吲哚基)羧基苯甲酸和适当的吲哚的反应制备的3,3-双(吲哚基)邻苯二甲酸酯，可用作压敏无碳复写系统、热标记系统和静电复印系统中的色素形成剂。
• Heteroarylphthalides
  申请人：Sterling Drug Inc.

  公开号：US04307018A1

  公开（公告）日：1981-12-22

  3-Aryl-3-indolylphthalides, 3-aryl-3-pyrrolylphthalides and 3-aryl-3-carbazolylphthalides prepared by interaction of the appropriate 2-(heteroaryl)carbonylbenzoic acid and the appropriate phenylamine, and 3,3-bis(indolyl)-phthalides prepared by the interaction of the appropriate 2-(indolyl)carbonylbenzoic acid and the appropriate indole are useful as color formers in pressure-sensitive carbonless duplicating systems, thermal marking systems and hectographic copying systems.

  3-芳基-3-吲哚基邻苯二甲酸酯、3-芳基-3-吡咯基邻苯二甲酸酯和3-芳基-3-咔唑基邻苯二甲酸酯是通过适当的2-(杂环芳基)羰基苯甲酸与适当的苯胺相互作用制备的，而3,3-双(吲哚基)-邻苯二甲酸酯是通过适当的2-(吲哚基)羰基苯甲酸与适当的吲哚相互作用制备的。它们在压敏无碳复写系统、热标记系统和铜版复印系统中作为色彩形成剂是有用的。
• 2-[(3-Indolyl)carbonyl]-4/5-carboxybenzoic acids
  申请人：Sterling Drug Inc.

  公开号：US04351768A1

  公开（公告）日：1982-09-28

  3-Aryl-3-indolylphthalides, 3-aryl-3-pyrrolylphthalides and 3-aryl-3-carbazolylphthalides prepared by interaction of the appropriate 2-(heteroaryl)carbonylbenzoic acid and the appropriate phenylamine, and 3,3-bis(indolyl)phthalides prepared by the interaction of the appropriate 2-(indolyl)carbonylbenzoic acid and the appropriate indole are useful as color formers in pressure-sensitive carbonless duplicating systems, thermal marking systems and hectographic copying systems.

  由适当的2-(杂环芳基)羧基苯甲酸和适当的苯胺相互作用制备的3-芳基-3-吲哚基苯酞、3-芳基-3-吡咯基苯酞和3-芳基-3-咔唑基苯酞，以及由适当的2-(吲哚基)羧基苯甲酸和适当的吲哚相互作用制备的3,3-双(吲哚基)苯酞在压敏无碳复写系统、热标记系统和静电复印系统中作为色素形成剂有用。
• US4189171A
  申请人：——

  公开号：US4189171A

  公开（公告）日：1980-02-19