2-[20-(Dicyanomethylidene)-7,17-bis[4-(trifluoromethyl)phenyl]-2,12-diazapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1,3(11),4(9),5,7,12,14(19),15,17-nonaen-10-ylidene]propanedinitrile | 1156494-16-4

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: 2-[20-(Dicyanomethylidene)-7,17-bis[4-(trifluoromethyl)phenyl]-2,12-diazapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1,3(11),4(9),5,7,12,14(19),15,17-nonaen-10-ylidene]propanedinitrile
• 英文别名: 2-[20-(dicyanomethylidene)-7,17-bis[4-(trifluoromethyl)phenyl]-2,12-diazapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1,3(11),4(9),5,7,12,14(19),15,17-nonaen-10-ylidene]propanedinitrile
• CAS: 1156494-16-4
• 化学式: C₃₈H₁₄F₆N₆
• 分子量: 668.56
• InChiKey: BMIXSBBVADVNBN-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  7
• 重原子数：
  50
• 可旋转键数：
  2
• 环数：
  7.0
• sp3杂化的碳原子比例：
  0.05
• 拓扑面积：
  121
• 氢给体数：
  0
• 氢受体数：
  12

反应信息

• 作为产物：
  描述：

  7,17-Bis[4-(trifluoromethyl)phenyl]-2,12-diazapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1,3(11),4(9),5,7,12,14(19),15,17-nonaene-10,20-dione 、 丙二腈 在 吡啶 作用下， 反应 24.0h， 生成 2-[20-(Dicyanomethylidene)-7,17-bis[4-(trifluoromethyl)phenyl]-2,12-diazapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1,3(11),4(9),5,7,12,14(19),15,17-nonaen-10-ylidene]propanedinitrile
  参考文献：
  名称：

  AZAINDENOFLUORENEDIONE DERIVATIVE, ORGANIC ELECTROLUMINESCENT DEVICE MATERIAL, AND ORGANIC ELECTROLUMINESCENT DEVICE

  摘要：

  公开号：

  EP2213662B1

文献信息

• COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENCE DEVICES, ORGANIC ELECTROLUMINESCENCE DEVICE, AND ELECTRONIC DEVICE
  申请人：IDEMITSU KOSAN CO., LTD.

  公开号：US20180182974A1

  公开（公告）日：2018-06-28

  A compound represented by formula (1): wherein each symbol is as defined in the specification, provides a high performance organic electroluminescence device which comprises a cathode, an anode and an organic layer between the cathode and the anode, wherein the organic layer comprises a light emitting layer and at least one layer of the organic layer comprises the compound.

  由以下公式表示的化合物（1）：其中每个符号如规范中定义，提供了一种高性能有机电致发光器件，该器件包括阴极、阳极和位于阴极和阳极之间的有机层，其中有机层包括发光层，并且至少有一层有机层包含该化合物。
• ORGANIC ELECTROLUMINESCENCE DEVICE AND ELECTRONIC DEVICE
  申请人：Idemitsu Kosan Co., Ltd.

  公开号：US20180179206A1

  公开（公告）日：2018-06-28

  A compound represented by formula (1): wherein R 1 to R 8 , R 12 to R 18 , R 21 to R 25 , R 31 to R 48 , L 1 to L 3 , and Ar are as defined in the specification, provides a high performance organic electroluminescence device which comprises a cathode, an anode and an organic layer between the cathode and the anode, wherein the organic layer comprises a light emitting layer and at least one layer of the organic layer comprises the compound.

  由式（1）表示的化合物：其中R1至R8，R12至R18，R21至R25，R31至R48，L1至L3和Ar如规范中定义的那样，提供了一种高性能的有机电致发光器件，该器件包括阴极、阳极和位于阴极与阳极之间的有机层，其中有机层包括发光层，至少有一层有机层包含该化合物。
• COMPOUND, ORGANIC ELECTROLUMINESCENCE ELEMENT MATERIAL, INK COMPOSITION, ORGANIC ELECTROLUMINESCENCE ELEMENT, ELECTRONIC DEVICE, AND METHOD FOR PRODUCING COMPOUND
  申请人：IDEMITSU KOSAN CO., LTD.

  公开号：US20160197288A1

  公开（公告）日：2016-07-07

  A compound represented by formula (1): wherein *a, *b, R 1 , X 1 , L 1 , L 2 , n, A 1 , and A 2 are as defined in the description, and a production method of the compound represented by formula (1) are provide. In the production method, A 1 is introduced under a reaction condition in which the reactivity of Hal 2 in a compound represented by formula (I): wherein *c, *d, R 1 , X 1 , L 1 , L 2 , n, A 1 , A 2 , Hal 1 , and Hal 2 are as defined in the description, is extremely low as compared with that of Hal 1 and then A 2 which is different from A 1 is introduced under a reaction condition in which the reactivity of Hal 2 is high. The compound represented by formula (1) is formed into a layer by a coating method and meets various performance requirements of an organic EL device.

  公式（1）所表示的化合物：其中*a，*b，R1，X1，L1，L2，n，A1和A2的定义如说明书中所定义，并且提供了化合物（1）的生产方法。在生产方法中，A1在反应条件下引入，其中在化合物（I）所表示的卤素2的反应性在Hal1相比下极低，其中* c，* d，R1，X1，L1，L2，n，A1，A2，Hal1和Hal2的定义如说明书中所定义，然后在Hal2的反应性高的反应条件下引入不同于A1的A2。化合物（1）通过涂覆方法形成一层，并满足有机EL器件的各种性能要求。
• Compound, organic electroluminescence element material, ink composition, organic electroluminescence element, electronic device, and method for producing compound
  申请人：IDEMITSU KOSAN CO., LTD.

  公开号：US10032991B2

  公开（公告）日：2018-07-24

  A compound represented by formula (1): wherein *a, *b, R1, X1, L1, L2, n, A1, and A2 are as defined in the description, and a production method of the compound represented by formula (1) are provide. In the production method, A1 is introduced under a reaction condition in which the reactivity of Hal2 in a compound represented by formula (I): wherein *c, *d, R1, X1, L1, L2, n, A1, A2, Hal1, and Hal2 are as defined in the description, is extremely low as compared with that of Hal1 and then A2 which is different from A1 is introduced under a reaction condition in which the reactivity of Hal2 is high. The compound represented by formula (1) is formed into a layer by a coating method and meets various performance requirements of an organic EL device.

  式 (1) 所代表的化合物： 其中 *a、*b、R1、X1、L1、L2、n、A1 和 A2 如说明中所定义，并提供了式 (1) 所代表化合物的生产方法。在该生产方法中，A1 是在 Hal2 在式 (I) 所代表化合物中的反应活性的反应条件下引入的： 其中 *c、*d、R1、X1、L1、L2、n、A1、A2、Hal1 和 Hal2 如说明中所定义、 与 Hal1 的反应活性相比，Hal2 的反应活性极低，然后在 Hal2 反应活性较高的反应条件下引入与 A1 不同的 A2。式（1）表示的化合物通过涂层方法形成一层，可满足有机电致发光器件的各种性能要求。
• Organic electroluminescent element
  申请人：Sony Corporation

  公开号：US10411212B2

  公开（公告）日：2019-09-10

  An organic electroluminescence device including: an anode; a cathode; two or more emitting units that are disposed between the anode and the cathode, each unit having an emitting layer; and a charge-generating layer that is disposed between the emitting units, wherein the charge-generating layer comprises an N layer nearer to the anode and a P layer nearer to the cathode, and the P layer comprises a compound represented by the following formula (I).

  一种有机电致发光器件，包括：一个阳极；一个阴极；两个或两个以上设置在阳极和阴极之间的发光单元，每个单元都有一个发光层；以及一个设置在发光单元之间的电荷发生层，其中电荷发生层包括一个靠近阳极的 N 层和一个靠近阴极的 P 层，P 层包括下式 (I) 所代表的化合物。