3,6-Diiminocyclohexa-1,4-diene-1-carbonitrile

• 分子结构分类: 有机化合物 - 有机氮化合物
• 英文名称: 3,6-Diiminocyclohexa-1,4-diene-1-carbonitrile
• 英文别名: 3,6-diiminocyclohexa-1,4-diene-1-carbonitrile
• 化学式: C₇H₅N₃
• 分子量: 131.13
• InChiKey: BGMZRDVRGWTSOI-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.1
• 重原子数：
  10
• 可旋转键数：
  0
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  71.5
• 氢给体数：
  2
• 氢受体数：
  3

文献信息

• Charge Transporting Semi-Conducting Material and Semi-Conducting Device
  申请人：NOVALED GMBH

  公开号：US20150349262A1

  公开（公告）日：2015-12-03

  The present invention relates to a charge transporting semi-conducting material comprising: a) optionally at least one electrical dopant, and b) at least one cross-linked charge-transporting polymer comprising 1,2,3-triazole cross-linking units, a method for its preparation and a semiconducting device comprising the charge transporting semi-conducting material.

  本发明涉及一种电荷传输半导体材料，包括：a) 可选的至少一种电性掺杂剂；和b) 至少一种交联的电荷传输聚合物，其中包括1,2,3-三唑交联单元，以及其制备方法和包括该电荷传输半导体材料的半导体器件。
• CHARGE TRANSPORTING SEMI-CONDUCTING MATERIAL AND ELECTRONIC DEVICE COMPRISING IT
  申请人：Novaled GmbH

  公开号：EP3208862A1

  公开（公告）日：2017-08-23

  The present invention relates to a charge transporting semi-conducting material comprising: a) optionally at least one electrical dopant, and b) a branched or cross-linked charge transporting polymer comprising 1,2,3-triazole cross-linking units of at least one of the general formulae Ia and/or Ib, wherein aa) Pol1- Pol4 are independently selected chains of the charge-transporting polymer, bb) X1, X2, X3, and X4 are independently selected spacer units or, independently, represent direct bonding of pol1 - Pol4 to the 1,2,3-triazole ring, cc) each of R and R' is independently selected from H halogen or a carbon-containing group, wherein the charge transporting polymer comprises ethylene building units substituted with at least one pending side group comprising a conjugated system of delocalised electrons , the charge transporting semi-conducting material being obtainable by a process comprising: i) providing a solution containing aaa) a first precursor charge transporting polymer comprising at least one covalently attached azide group and optionally at least one acetylenic group; and/or a second precursor charge transporting polymer comprising at least one covalently attached acetylenic group and optionally at least one azide group; and optionally at least one crosslinking agent comprising at least two functional groups selected from azide and/or acetylenic group, bbb) optionally at least one electrical dopant, ccc) at least one solvent, ii) depositing the solution on a substrate, iii) removing the solvent, and iv) reacting the azide and acetylenic groups to effect crosslinking, preferably by heating, wherein at least one of the first and second precursor charge transporting polymer comprises ethylene building units substituted with at least one pending side group comprising a conjugated system of delocalised electrons, a first and a second precursor charge transporting polymer used therein, a process for preparing the inventive charge transporting semi-conducting material and an electronic device comprising the same.

  本发明涉及一种电荷传输半导电材料，包括 a) 可选的至少一种电掺杂剂，以及 b) 由通式 Ia 和/或 Ib 中至少一种的 1,2,3-三唑交联单元组成的支化或交联电荷传输聚合物、 其中 aa) Pol1- Pol4 是独立选定的电荷传输聚合物链、 bb)X1、X2、X3 和 X4 是独立选定的间隔单元，或独立地代表 pol1 - Pol4 与 1，2，3-三唑环的直接键合、 cc) R 和 R'各自独立地选自卤素或含碳基团、 其中，电荷传输聚合物包含被至少一个待定侧基取代的乙烯结构单元，该待定侧基包含一个分散电子的共轭体系、 电荷传输半导电材料可通过以下工艺获得，包括 i) 提供含有以下成分的溶液 aaa) 第一种前体电荷传输聚合物，包含至少一个共价连接的叠氮基团和可选的 至少一个乙炔基团；和/或第二种前体电荷传输聚合物，包含至少一个共价 连接的乙炔基团和可选的至少一个叠氮基团；以及可选的至少一种交联剂， 包含至少两个选自叠氮基团和/或乙炔基团的官能团、 bbb) 可选的至少一种电掺杂剂、 ccc) 至少一种溶剂、 ii) 将溶液沉积在基底上、 去除溶剂，以及 iv) 使叠氮基团和乙炔基团发生反应以实现交联，最好是通过加热、 其中第一和第二前体电荷传输聚合物中的至少一种包含被至少一个待定侧基取代的乙烯结构单元，该待定侧基包含一个脱电子共轭体系、 其中使用的第一和第二前体电荷传输聚合物、制备本发明电荷传输半导电材料的工艺以及包含该材料的电子设备。
• Charge transporting semi-conducting material and electronic device comprising it
  申请人：Novaled GmbH

  公开号：US10468601B2

  公开（公告）日：2019-11-05

  The present invention relates to a charge transporting semi-conducting material. The charge transporting semi-conducting material may include optionally at least one electrical dopant, and a branched or cross-linked charge transporting polymer that includes 1,2,3-triazole cross-linking units of at least one of the general formulae Ia and/or Ib herein. The charge transporting polymer can include ethylene building units substituted with at least one pending side group including a conjugated system of delocalized electrons. Also provided herein are processes for obtaining the charge transporting semi-conducting material.

  本发明涉及一种电荷传输半导电材料。电荷传输半导电材料可包括 可选的至少一种电掺杂剂，以及 支化或交联电荷传输聚合物，其中包括本文通式 Ia 和/或 Ib 中至少一种的 1，2，3-三唑交联单元。 电荷传输聚合物可包括被至少一个待定侧基取代的乙烯结构单元，该侧基包括一个脱电子共轭体系。本文还提供了获得电荷传输半导电材料的工艺。
• Charge transporting semi-conducting material and semi-conducting device
  申请人：Novaled GmbH

  公开号：US11322687B2

  公开（公告）日：2022-05-03

  The present invention relates to a charge transporting semi-conducting material comprising: a) optionally at least one electrical dopant, and b) at least one cross-linked charge-transporting polymer comprising 1,2,3-triazole cross-linking units, a method for its preparation and a semiconducting device comprising the charge transporting semi-conducting material.

  本发明涉及一种电荷传输半导电材料，该材料包括：a) 可选的至少一种电掺杂剂；b) 至少一种交联电荷传输聚合物，该聚合物包含 1，2，3-三唑交联单元；本发明还涉及一种制备方法和一种包含该电荷传输半导电材料的半导体器件。
• CHARGE TRANSPORTING SEMI-CONDUCTING MATERIAL AND SEMI-CONDUCTING DEVICE
  申请人：Novaled GmbH

  公开号：EP2893576B1

  公开（公告）日：2018-04-04