3-bromo-7,9-bis(3,5-di-tert-butylphenyl)-8H-cyclopenta[a]acenaphthylen-8-one | 512787-15-4

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 二芳基庚烷
• 英文名称: 3-bromo-7,9-bis(3,5-di-tert-butylphenyl)-8H-cyclopenta[a]acenaphthylen-8-one
• 英文别名: 3-Bromo-7,9-bis(3,5-ditert-butylphenyl)cyclopenta[a]acenaphthylen-8-one
• CAS: 512787-15-4
• 化学式: C₄₃H₄₇BrO
• 分子量: 659.75
• InChiKey: TZPVEZORHJCSRK-UHFFFAOYSA-N

物化性质

• 沸点：
  735.2±60.0 °C(Predicted)
• 密度：
  1.22±0.1 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  13.1
• 重原子数：
  45
• 可旋转键数：
  6
• 环数：
  6.0
• sp3杂化的碳原子比例：
  0.37
• 拓扑面积：
  17.1
• 氢给体数：
  0
• 氢受体数：
  1

反应信息

• 作为反应物：
  描述：

  苊烯 、 3-bromo-7,9-bis(3,5-di-tert-butylphenyl)-8H-cyclopenta[a]acenaphthylen-8-one 以 xylene 为溶剂， 反应 24.0h， 以80%的产率得到3-bromo-7,14-bis(3,5-di-tert-butylphenyl)acenaphtho[1,2-k]fluoranthene
  参考文献：
  名称：

  Synthesis of Polyaromatic Hydrocarbons with a Central Rotor

  摘要：

  A series of molecular landers comprising a central mobile part has been synthesised. The two rigid main boards consist of acenaphtho[1,2-k]fluoranthene groups, each substituted in positions 7 and 14 by 3,5-di-tert-butylphenyl groups. The boards are linked by a diethynylanthracene, a phenyl, or a biphenyl rotor. ((C) Wiley-VCH Verlag GmbH & Co KGaA, 69451 Weinheim, Germany, 2002).

  DOI：

  10.1002/1099-0690(200212)2002:24<4185::aid-ejoc4185>3.0.co;2-z
• 作为产物：
  描述：

  3,5-二叔丁基苄溴 在 氢氧化钾 、 对甲基苯磺酰甲基异腈 、 sodium hydride 作用下， 以 甲醇 为溶剂， 反应 4.5h， 生成 3-bromo-7,9-bis(3,5-di-tert-butylphenyl)-8H-cyclopenta[a]acenaphthylen-8-one
  参考文献：
  名称：

  Synthesis of Polyaromatic Hydrocarbons with a Central Rotor

  摘要：

  A series of molecular landers comprising a central mobile part has been synthesised. The two rigid main boards consist of acenaphtho[1,2-k]fluoranthene groups, each substituted in positions 7 and 14 by 3,5-di-tert-butylphenyl groups. The boards are linked by a diethynylanthracene, a phenyl, or a biphenyl rotor. ((C) Wiley-VCH Verlag GmbH & Co KGaA, 69451 Weinheim, Germany, 2002).

  DOI：

  10.1002/1099-0690(200212)2002:24<4185::aid-ejoc4185>3.0.co;2-z

文献信息

• [EN] NOVEL ORGANIC COMPOUND, ORGANIC LIGHT EMITTING DEVICE, AND IMAGE DISPLAY DEVICE<br/>[FR] NOUVEAU COMPOSÉ ORGANIQUE, DISPOSITIF ORGANIQUE ÉMETTANT DE LA LUMIÈRE, ET DISPOSITIF D'AFFICHAGE D'IMAGES
  申请人：CANON KK

  公开号：WO2013084833A1

  公开（公告）日：2013-06-13

  To provide a novel organic compound suitable for an organic light emitting device. This invention provides an organic compound having the skeleton represented by Formula ( 1 ).

  为了提供一种适用于有机发光器件的新型有机化合物。本发明提供了一种具有由式（1）表示的骨架的有机化合物。
• Organic compound, organic light-emitting element, display apparatus, image pickup apparatus, electronic device, and moving object
  申请人：CANON KABUSHIKI KAISHA

  公开号：US11196007B2

  公开（公告）日：2021-12-07

  An organic compound represented by formula (1) and an organic compound represented by formula (2). These organic compounds provide high color purity. In formulae (1) and (2), R1 to R24 are each independently selected from the group consisting of a hydrogen atom and a substituent.

  式 (1) 所代表的有机化合物和式 (2) 所代表的有机化合物。这些有机化合物具有很高的颜色纯度。 在式 (1) 和 (2) 中，R1 至 R24 各自独立地选自由氢原子和取代基组成的组。
• NOVEL ORGANIC COMPOUND, ORGANIC LIGHT EMITTING DEVICE, AND IMAGE DISPLAY DEVICE
  申请人：Canon Kabushiki Kaisha

  公开号：EP2788306B1

  公开（公告）日：2017-05-03
• ORGANIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE HAVING THE SAME
  申请人：Kamatani Jun

  公开号：US20130033416A1

  公开（公告）日：2013-02-07

  An organic compound contains indacenodiperylene as the basic skeleton.
• ORGANIC COMPOUND, ORGANIC LIGHT-EMITTING ELEMENT, DISPLAY APPARATUS, IMAGE PICKUP APPARATUS, ELECTRONIC DEVICE, AND MOVING OBJECT
  申请人：CANON KABUSHIKI KAISHA

  公开号：US20200111964A1

  公开（公告）日：2020-04-09

  An organic compound represented by formula (1) and an organic compound represented by formula (2). These organic compounds provide high color purity. In formulae (1) and (2), R 1 to R 24 are each independently selected from the group consisting of a hydrogen atom and a substituent.