7-methyl-1-p-tolylisoquinoline | 872509-36-9

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡啶及其衍生物
• 英文名称: 7-methyl-1-p-tolylisoquinoline
• 英文别名: 7-Methyl-1-(4-methylphenyl)isoquinoline
• CAS: 872509-36-9
• 化学式: C₁₇H₁₅N
• 分子量: 233.313
• InChiKey: KJVXXLQYJAHOSF-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.5
• 重原子数：
  18
• 可旋转键数：
  1
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.12
• 拓扑面积：
  12.9
• 氢给体数：
  0
• 氢受体数：
  1

反应信息

• 作为反应物：
  描述：

  氯化铱(III) 水合物 、 7-methyl-1-p-tolylisoquinoline 以 乙二醇乙醚 、 乙醚 为溶剂， 生成 [(7-methyl-1-p-tolylisoquinolinato-N,C(2'))2Ir(μ-Cl)2Ir(7-methyl-1-p-tolylisoquinolinato-N,C(2'))2]
  参考文献：
  名称：

  双取代对苯基异喹啉铱（III）配合物的影响

  摘要：

  本文研究了一系列双取代的苯基异喹啉铱（III）配合物的合成和光物理性质。有趣的是，即使单晶X射线晶体学数据显示存在空间位阻，也可以制备双[3-甲基-1-对甲苯基喹啉基-N，C 2 ']铱（III）（乙酰丙酮）（6a1）。由于在C-3位上的甲基对异喹啉有阻碍作用。值得注意的是，循环伏安（CV）测量表明，尽管这些铱（III）配合物具有相似的能隙，但它们的E 1/2（ox）不同于单取代的（在苯环中）苯基异喹啉铱（III）配合物。这说明铱（III）配合物氧化电位的主要影响是取代的异喹啉环。而在红色区域发射的所有这些配合物，双[5-甲基-1- p -tolylisoquinolinato- Ñ，c ^ 2 “]铱（III）（乙酰丙酮）（6C1）显示9299.36烛光/米的更高的亮度2在在电流密度J = 0.28 mA / cm 2时，更高的电流密度J = 63.69 mA / cm 2和更好的发光效率21

  DOI：

  10.1021/om050638p

文献信息

• Red phosphorescent compounds and organic electroluminescent devices using the same
  申请人：Kim Jung Keun

  公开号：US20070128468A1

  公开（公告）日：2007-06-07

  Disclosed herein are red phosphorescent compounds of the following Formulas 1 to 3: wherein R1 and R2 are independently a C 1 -C 4 alkyl group, R3, R4, R5 and R6 are independently selected from hydrogen, C 1 -C 4 alkyl groups and C 1 -C 4 alkoxy groups, and is selected from 2,4-pentanedione, 2,2,6,6,-tetramethylheptane-3,5-dione, 1,3-propanedione, 1,3-butanedione, 3,5-heptanedione, 1,1,1-trifluoro-2,4-pentanedione, 1,1,1,5,5,5-hexafluoro-2,4-pentanedione, and 2,2-dimethyl-3,5-hexanedione; wherein R1, R2, R3 and R4 are independently selected from C 1 -C 4 alkyl groups and C 1 -C 4 alkoxy groups, and is selected from 2,4-pentanedione, 2,2,6,6,-tetramethylheptane-3,5-dione, 1,3-propanedione, 1,3-butanedione, 3,5-heptanedione, 1,1,1-trifluoro-2,4-pentanedione, 1,1,1,5,5,5-hexafluoro-2,4-pentanedione and 2,2-dimethyl-3,5-hexanedione; wherein R1, R2, R3 and R4 are independently selected from hydrogen, C 1 -C 4 alkyl groups and C 1 -C 4 alkoxy groups, and is selected from 2,4-pentanedione, 2,2,6,6,-tetramethylheptane-3,5-dione, 1,3-propanedione, 1,3-butanedione, 3,5-heptanedione, 1,1,1-trifluoro-2,4-pentanedione, 1,1,1,5,5,5-hexafluoro-2,4-pentanedione and 2,2-dimethyl-3,5-hexanedione. Further disclosed herein is an organic electroluminescent (EL) device comprising an anode, a hole injecting layer, a hole transport layer, a light-emitting layer, an electron transport layer, an electron injecting layer, and a cathode laminated in this order wherein one of the red phosphorescent compounds is used as a dopant of the light-emitting layer.

  本文披露了以下1至3式的红色磷光化合物：其中，R1和R2分别是C1-C4烷基，R3、R4、R5和R6独立选择自氢、C1-C4烷基和C1-C4烷氧基，且为2,4-戊二酮、2,2,6,6-四甲基庚烷-3,5-二酮、1,3-丙二酮、1,3-丁二酮、3,5-庚二酮、1,1,1-三氟-2,4-戊二酮、1,1,1,5,5,5-六氟-2,4-戊二酮和2,2-二甲基-3,5-己二酮中选择；其中，R1、R2、R3和R4独立选择自C1-C4烷基和C1-C4烷氧基，且为2,4-戊二酮、2,2,6,6-四甲基庚烷-3,5-二酮、1,3-丙二酮、1,3-丁二酮、3,5-庚二酮、1,1,1-三氟-2,4-戊二酮、1,1,1,5,5,5-六氟-2,4-戊二酮和2,2-二甲基-3,5-己二酮中选择；其中，R1、R2、R3和R4独立选择自氢、C1-C4烷基和C1-C4烷氧基，且为2,4-戊二酮、2,2,6,6-四甲基庚烷-3,5-二酮、1,3-丙二酮、1,3-丁二酮、3,5-庚二酮、1,1,1-三氟-2,4-戊二酮、1,1,1,5,5,5-六氟-2,4-戊二酮和2,2-二甲基-3,5-己二酮中选择。本文进一步披露了一种有机电致发光（EL）器件，包括依次层叠的阳极、空穴注入层、空穴传输层、发光层、电子传输层、电子注入层和阴极，其中，红色磷光化合物中的一种被用作发光层的掺杂剂。
• METAL COMPLEX, POLYMER COMPOUND AND DEVICE USING THE SAME
  申请人：Okamura Rei

  公开号：US20120205585A1

  公开（公告）日：2012-08-16

  A metal complex represented by the following formula (1): wherein R 1 to R 6 , R 8 and R 11 to R 20 represent a hydrogen atom, a halogen atom, an alkyl group, an alkoxy group, an alkylthio group, an aryl group, an aryloxy group, an arylthio group, an arylalkyl group, an arylalkoxy group, an arylalkylthio group, an acyl group, an acyloxy group, an amide group, an acid imide group, an imine residue, a substituted amino group, a substituted silyl group, a substituted silyloxy group, a substituted silylthio group, a substituted silylamino group, a monovalent heterocyclic group, a heteroaryloxy group, a heteroarylthio group, an arylalkenyl group, an arylalkynyl group, a substituted carboxyl group or a cyano group; Z 1 to Z 5 represent —C(R*)═ or a nitrogen atom, wherein R* represents a hydrogen atom or a substituent, provided that at least two of Z 1 to Z 5 are nitrogen atoms; m represents 1 or 2.
• US8501328B2
  申请人：——

  公开号：US8501328B2

  公开（公告）日：2013-08-06