9-bromo-10-(4-chlorophenyl)anthracene | 158902-12-6

• 分子结构分类: 有机化合物 - 木脂素、新木脂素和相关化合物 - 芳基萘木脂素
• 英文名称: 9-bromo-10-(4-chlorophenyl)anthracene
• CAS: 158902-12-6
• 化学式: C₂₀H₁₂BrCl
• 分子量: 367.672
• InChiKey: PGEUNRGGMJOLIB-UHFFFAOYSA-N

物化性质

• 沸点：
  472.4±30.0 °C(Predicted)
• 密度：
  1.464±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  7.4
• 重原子数：
  22
• 可旋转键数：
  1
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  0
• 氢给体数：
  0
• 氢受体数：
  0

反应信息

• 作为反应物：
  描述：

  9-bromo-10-(4-chlorophenyl)anthracene 在 正丁基锂 、 重水 作用下， 生成 9-(4-Chlorophenyl)anthracene-10-d
  参考文献：
  名称：

  Aryl Proton Transfer Reactions of 9-Arylanthracene and 9-Substituted Anthracene Radical Cations with 2,6-Di-tert-butylpyridine

  摘要：

  Radical cations of anthracenes with substituents at the O-position (Br, CN, or NO2) or those of 9-arylanthracenes were observed to undergo proton transfer reactions with 2,6-di-tert-butylpyridine (TBP) to generate the corresponding anthracenyl radical. Under the same conditions 2,6-dimethylpyridine (LUT) undergoes combination reactions with the radical cations, and the proton transfer reactions could not be detected. The characteristic features of the reactions producing the anthracenyl radicals are as follows: (a) primary deuterium kinetic isotope effects are observed on substitution of the 10-H with 10-D, (b) the apparent Arrhenius activation energies vary from -2 to -11 kcal/mol, and (c) 10-Br-substituted anthracenes are formed during bromine atom abstraction from bromoform by the free radicals. The intermediate bromo derivatives are further oxidized under the reaction conditions. A two-step mechanism involving a reversible pi-complex formation followed by rate-determining proton transfer is proposed. The results of the reactions with TBP are compared to those obtained from the corresponding reactions of the radical cations with LUT.

  DOI：

  10.1021/jo00101a015
• 作为产物：
  描述：

  9-(4-chlorophenyl)anthracene 在 N-溴代丁二酰亚胺(NBS) 作用下， 以 DMF (N,N-dimethyl-formamide) 为溶剂， 以89%的产率得到9-bromo-10-(4-chlorophenyl)anthracene
  参考文献：
  名称：

  EP1496041

  摘要：

  公开号：

文献信息

• 一种有机化合物及其应用
  申请人：武汉天马微电子有限公司

  公开号：CN113773339A

  公开（公告）日：2021-12-10

  本发明提供一种有机化合物及其应用，所述有机化合物具有较深的LUMO能级，可以降低电子传输的势垒，提高电子的注入能力，有效降低OLED的器件电压；化合物均具有较深的HOMO能级，这可以有效地阻挡空穴，使更多的空穴‑电子在发光区进行复合，可以实现较高的发光效率。适用于OLED器件的电子传输层材料，能够降低器件的电压和功耗，提高发光效率，延长工作寿命，使OLED器件具有更好的综合性能。
• Novel aromatic compound and organic electroluminescent element containing the same
  申请人：Ikeda Hidetsugu

  公开号：US20050214565A1

  公开（公告）日：2005-09-29

  A novel aromatic compound having an anthracene skeleton structure and an asymmetric molecular structure; and an organic electroluminescence device which comprises a cathode, an anode and an organic thin film layer comprising at least one layer containing a light emitting layer and sandwiched between the cathode and the anode in which at least one layer in the organic thin film layer contains the above novel aromatic compound singly or as a component of a mixture. The organic electroluminescence device exhibits a great luminance of emitted light, a great efficiency of light emission and a high purity of color, emits bluish light, is excellent in stability at high temperatures and has a long life. The organic electroluminescence device can be provided by utilizing the novel aromatic compound.

  一种具有蒽骨架结构和不对称分子结构的新型芳香化合物；以及一种有阴极、阳极和有机薄膜层的有机电致发光装置，该有机薄膜层至少包含一个包含发光层的层，并夹在阴极和阳极之间，其中有机薄膜层中的至少一层单独或作为混合物成分包含上述新型芳香化合物。该有机电致发光装置显示出发射光的大亮度、高效率的发光和高纯度的颜色，发出蓝色光，高温稳定性优异且寿命长。可以利用该新型芳香化合物提供有机电致发光装置。
• NOVEL AROMATIC COMPOUND AND ORGANIC ELECTROLUMINESCNET ELEMENT CONTAINING THE SAME
  申请人：IDEMITSU KOSAN CO., LTD.

  公开号：EP1496041A1

  公开（公告）日：2005-01-12

  A novel aromatic compound having an anthracene skeleton structure and an asymmetric molecular structure; and an organic electroluminescence device which comprises a cathode, an anode and an organic thin film layer comprising at least one layer containing a light emitting layer and sandwiched between the cathode and the anode in which at least one layer in the organic thin film layer contains the above novel aromatic compound singly or as a component of a mixture. The organic electroluminescence device exhibits a great luminance of emitted light, a great efficiency of light emission and a high purity of color, emits bluish light, is excellent in stability at high temperatures and has a long life. The organic electroluminescence device can be provided by utilizing the novel aromatic compound.

  一种具有蒽骨架结构和不对称分子结构的新型芳香族化合物；以及一种有机电致发光器件，该器件包括一个阴极、一个阳极和一个有机薄膜层，该有机薄膜层至少包含一层发光层并夹在阴极和阳极之间，其中有机薄膜层中至少有一层单独含有上述新型芳香族化合物或作为混合物的组分。这种有机电致发光器件的发光亮度高、发光效率高、颜色纯度高，能发出蓝光，在高温下稳定性好，使用寿命长。利用新型芳香族化合物可以提供有机电致发光器件。
• WO2007/123339
  申请人：——

  公开号：——

  公开（公告）日：——
• EP1496041
  申请人：——

  公开号：——

  公开（公告）日：——