1-methyl-2-(pyridin-4-yl)-1H-benzo[d]imidazole | 64262-98-2

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 苯并咪唑类
• 英文名称: 1-methyl-2-(pyridin-4-yl)-1H-benzo[d]imidazole
• 英文别名: 1-methyl-2-pyridin-4-yl-1H-benzoimidazole；1-methyl-2-pyridin-4-yl-1H-benzimidazole；1-methyl-2-pyridin-4-yl-1H-benzoimidazole；1-methyl-2-pyridin-4-ylbenzimidazole
• CAS: 64262-98-2
• 化学式: C₁₃H₁₁N₃
• mdl: MFCD00182082
• 分子量: 209.25
• InChiKey: JFHRYURGMJNMJG-UHFFFAOYSA-N

物化性质

• 溶解度：
  >31.4 [ug/mL]

计算性质

• 辛醇/水分配系数(LogP)：
  2
• 重原子数：
  16
• 可旋转键数：
  1
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.076
• 拓扑面积：
  30.7
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  1-methyl-2-(pyridin-4-yl)-1H-benzo[d]imidazole 在 ammonium hexafluorophosphate 作用下， 以 水 、 乙腈 为溶剂， 反应 26.5h， 生成 2-(1-hexylpyridin-1-ium-4-yl)-1,3-dimethyl-1H-benzimidazol-3-ium bis(hexafluorophosphate)
  参考文献：
  名称：

  [EN] ELECTROCHROMIC COMPOUNDS AND OPTICAL ARTICLES CONTAINING THEM
  [FR] COMPOSÉS ÉLECTROCHROMIQUES ET ARTICLES OPTIQUES LES CONTENANT

  摘要：

  The invention relates to a group of novel electrochromic compounds. More specifically, it relates to benzazoles and condensed azole compounds substituted with one or several pyridinium rings and the use of these compounds as a variable transmittance medium for the manufacture of an optical article, such as an ophthalmic lens.

  公开号：

  WO2022136020A1
• 作为产物：
  描述：

  邻苯二胺 在 potassium hydroxide 作用下， 以 乙醇 、 丙酮 为溶剂， 反应 74.0h， 生成 1-methyl-2-(pyridin-4-yl)-1H-benzo[d]imidazole
  参考文献：
  名称：

  [EN] ELECTROCHROMIC COMPOUNDS AND OPTICAL ARTICLES CONTAINING THEM
  [FR] COMPOSÉS ÉLECTROCHROMIQUES ET ARTICLES OPTIQUES LES CONTENANT

  摘要：

  The invention relates to a group of novel electrochromic compounds. More specifically, it relates to benzazoles and condensed azole compounds substituted with one or several pyridinium rings and the use of these compounds as a variable transmittance medium for the manufacture of an optical article, such as an ophthalmic lens.

  公开号：

  WO2022136020A1

文献信息

• PHENANTHRENE DERIVATIVE, AND MATERIAL FOR ORGANIC EL ELEMENT
  申请人：Kawamura Masahiro

  公开号：US20100331585A1

  公开（公告）日：2010-12-30

  A phenanthrene derivative is represented by a formula (1) below. In the formula (1), Ar 1 and Ar 2 each represent an aromatic hydrocarbon ring group having 6 to 18 carbon atoms for forming the ring. The aromatic hydrocarbon ring group contains none of anthracene skeleton, pyrene skeleton, aceanthrylene skeleton and naphthacene skeleton. R 1 represents a substituent, the number of which may be 0, 1 or more. R 1 may be bonded in any position of the phenanthrene skeleton. n and m each represent an integer of 1 to 3. k represents an integer of 0 to 8.

  一个菲的衍生物由下面的公式（1）表示。在公式（1）中，Ar1和Ar2分别代表含有6到18个碳原子形成环的芳香烃环基团。芳香烃环基团不包含蒽骨架、芘骨架、乙酰芘骨架和萘骨架。R1代表一个取代基，其数量可以是0、1或更多。R1可以连接在菲的骨架的任何位置。n和m分别代表1到3的整数。k代表0到8的整数。
• NAPHTHALENE DERIVATIVE, MATERIAL FOR ORGANIC ELECTROLUMINESCENCE DEVICE, AND ORGANIC ELECTROLUMINESCENCE DEVICE USING THE SAME
  申请人：Kawamura Masahiro

  公开号：US20090008607A1

  公开（公告）日：2009-01-08

  A naphthalene derivative represented by the following formula (1) is provided. In the formula (1), Ar 1 and Ar 2 each represent an aromatic hydrocarbon cyclic group having 6 to 18 carbon atoms forming a ring. The aromatic hydrocarbon cyclic group has none of anthracene skeleton, pyrene skeleton, aceanthrylene skeleton and naphthacene skeleton. Ar 3 represents a benzene skeleton or a naphthalene skeleton. R 1 and R 2 each represent an alkyl group, a cycloalkyl group, an alkoxy group, a cyano group, a silyl group or a halogen atom. a and b each represent an integer in a range of 0 to 4. m and n each represent an integer in a range of 1 to 4.

  提供以下式子（1）所表示的萘衍生物。在式子（1）中，Ar1和Ar2分别代表具有6到18个碳原子形成环的芳香族碳氢循环基团。芳香族碳氢循环基团中不含蒽骨架、芘骨架、乙烯基蒽骨架和萘并蒽骨架。Ar3代表苯骨架或萘骨架。R1和R2分别代表烷基、环烷基、烷氧基、氰基、硅烷基或卤素原子。a和b分别代表0到4范围内的整数。m和n分别代表1到4范围内的整数。
• ORGANIC ELECTROLUMINESCENCE DEVICE AND MATERIAL FOR ORGANIC ELECTROLUMINESCENCE DEVICE
  申请人：Nishimura Kazuki

  公开号：US20090045730A1

  公开（公告）日：2009-02-19

  An organic electroluminescence device includes: a cathode; an anode; and a single-layered or multilayered organic thin-film layer provided between the cathode and the anode. The organic thin-film layer includes at least one emitting layer. The at least one emitting layer contains at least one phosphorescent material and a host material represented by the following formula (1). Ra-Ar 1 -Rb  (1) In the formula, Ar 1 , Ra and Rb each represent a substituted or unsubstituted benzene ring or a condensed aromatic hydrocarbon ring selected from a substituted or unsubstituted naphthalene ring, a substituted or unsubstituted chrysene ring, a substituted or unsubstituted fluoranthene ring, a substituted or unsubstituted phenanthrene ring, a substituted or unsubstituted benzophenanthrene ring, a substituted or unsubstituted dibenzophenanthrene ring, a substituted or unsubstituted triphenylene ring, a substituted or unsubstituted benzo[a]triphenylene ring, a substituted or unsubstituted benzochrysene ring, a substituted or unsubstituted benzo[b]fluoranthene ring and a substituted or unsubstituted picene ring. Substituents for Ra and Rb are not aryl groups.

  有机电致发光器件包括：阴极；阳极；以及设置在阴极和阳极之间的单层或多层有机薄膜层。有机薄膜层包括至少一个发光层。该至少一个发光层包含至少一种磷光材料和由以下式（1）表示的主体材料。Ra-Ar1-Rb  （1）在该式中，Ar1、Ra和Rb各自表示取代或未取代的苯环或选自取代或未取代的萘环、取代或未取代的蒽环、取代或未取代的芴环、取代或未取代的菲环、取代或未取代的苯并菲环、取代或未取代的二苯并菲环、取代或未取代的三苯基烷环、取代或未取代的苯并三苯基烷环、取代或未取代的苯并蒽环、取代或未取代的苯并芴环和取代或未取代的苊环的缩合芳香烃环。Ra和Rb的取代基不是芳基基团。
• MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, AND ORGANIC ELECTROLUMINESCENT ELEMENT
  申请人：Takashima Yoriyuki

  公开号：US20110315965A1

  公开（公告）日：2011-12-29

  An organic electroluminescence device and a material for producing the organic electroluminescence device. The organic electroluminescence device includes an organic thin film layer between a cathode and an anode, the organic thin film layer including one or more layers, in which the organic thin film layer includes one or more light emitting layers and at least one of the light emitting layers includes a phosphorescent material and a host material. The host material has an essential structure in which a naphthalene ring is bonded to a fluorene skeleton, dibenzofuran skeleton, or dibenzothiophene skeleton. The organic electroluminescence device is a phosphorescent device having high efficiency and long lifetime.

  一种有机电致发光器件和制备该有机电致发光器件的材料。该有机电致发光器件包括在阴极和阳极之间的有机薄膜层，该有机薄膜层包括一个或多个层，其中有机薄膜层包括一个或多个发光层，至少一个发光层包括磷光材料和主体材料。主体材料具有一个必要的结构，其中萘环连接到芴骨架、二苯并呋喃骨架或二苯并噻吩骨架。该有机电致发光器件是一种具有高效率和长寿命的磷光器件。
• ORGANIC ELECTROLUMINESCENCE DEVICE
  申请人：Idemitsu Kosan Co., Ltd.

  公开号：EP2053672A1

  公开（公告）日：2009-04-29

  An organic electroluminescent device, including: a cathode; an anode; and organic layers including at least an emitting layer and an electron-transporting layer between the cathode and the anode, the electron-transporting material with the slowest electron mobility constituting the electron-transporting layer having an electron mobility of 2.0×10-5 cm2/Vs or more in an electric field intensity of 0.4 to 0.5 MV/cm, the electron mobility/hole mobility (ΔEM) of a host material constituting the emitting layer, and the electron mobility/hole mobility (ΔET) of the electron-transporting material with the slowest electron mobility constituting the electron-transporting layer satisfying the following relationship: ΔET > 1, 0.3 ≤ ΔEM ≤ 10, and ΔET > ΔEM.

  一种有机电致发光器件，包括：阴极；阳极；以及至少包括发光层和位于阴极与阳极之间的电子传输层的有机层，构成电子传输层的电子迁移率最慢的电子传输材料在电场强度为0.4至0.5 MV/cm，构成发射层的主材料的电子迁移率/空穴迁移率(ΔEM)和构成电子传输层的电子迁移率最慢的电子传输材料的电子迁移率/空穴迁移率(ΔET)满足以下关系：ΔET>1，0.3≤ΔEM≤10，且ΔET>ΔEM。