2,4-diiodo-6-phenyl-1,3,5-triazine | 1256170-11-2

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 三嗪类
• 英文名称: 2,4-diiodo-6-phenyl-1,3,5-triazine
• CAS: 1256170-11-2
• 化学式: C₉H₅I₂N₃
• 分子量: 408.968
• InChiKey: DJMMMSQPDGQWMM-UHFFFAOYSA-N

物化性质

• 熔点：
  188.5-190.3 °C
• 沸点：
  495.1±28.0 °C(Predicted)
• 密度：
  2.290±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  3
• 重原子数：
  14
• 可旋转键数：
  1
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  38.7
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  2,4-diiodo-6-phenyl-1,3,5-triazine 、 3-溴环己烯 在 仲丁基氯化镁 、 copper(I) cyanide di(lithium chloride) 作用下， 以 四氢呋喃 为溶剂， 反应 0.17h， 以67%的产率得到2,4-di(cyclohex-2-en-1-yl)-6-phenyl-1,3,5-triazine
  参考文献：
  名称：

  Preparation of 2-Magnesiated 1,3,5-Triazines via an Iodine−Magnesium Exchange

  摘要：

  Functionalized iodo- and diiodo-1,3,5-triazine derivatives readily undergo an I/Mg exchange with BuMgCl, sBuMgCl, or OctMgBr at low temperatures. furnishing 2-magnesiated and 2-zincated 1,3,5-triazines (after transmetalation with ZnCl2). This method also offers a convenient access to dimagnesiated triazines. Furthermore, it allows the preparation of functionalized 1,3,5-triazinyl dimers and trimers, interesting for their optoelectronic properties.

  DOI：

  10.1021/ol102173z
• 作为产物：
  描述：

  2,4-二氯-6-苯基-1,3,5-三嗪 在 氢碘酸 、 potassium carbonate 、 sodium sulfite 作用下， 以 水 为溶剂， 以67%的产率得到2,4-diiodo-6-phenyl-1,3,5-triazine
  参考文献：
  名称：

  Preparation of 2-Magnesiated 1,3,5-Triazines via an Iodine−Magnesium Exchange

  摘要：

  Functionalized iodo- and diiodo-1,3,5-triazine derivatives readily undergo an I/Mg exchange with BuMgCl, sBuMgCl, or OctMgBr at low temperatures. furnishing 2-magnesiated and 2-zincated 1,3,5-triazines (after transmetalation with ZnCl2). This method also offers a convenient access to dimagnesiated triazines. Furthermore, it allows the preparation of functionalized 1,3,5-triazinyl dimers and trimers, interesting for their optoelectronic properties.

  DOI：

  10.1021/ol102173z

文献信息

• Stable but Reactive Perfluoroalkylzinc Reagents: Application in Ligand-Free Copper-Catalyzed Perfluoroalkylation of Aryl Iodides
  作者：Kohsuke Aikawa、Yuzo Nakamura、Yuki Yokota、Wataru Toya、Koichi Mikami

  DOI：10.1002/chem.201405677

  日期：2015.1.2

  The aromatic perfluoroalkylation catalyzed by a copper(I) salt with bis(perfluoroalkyl)zinc reagents Zn(RF)2(DMPU)2, which were prepared and then isolated as a stable white powder from perfluoroalkyl iodide and diethylzinc, was accomplished to provide the perfluoroalkylated products in good‐to‐excellent yields. The advantages of this reliable and practical catalytic reaction are 1) air‐stable and easy‐to‐handle

  制备了铜（I）盐与双（全氟烷基）锌试剂Zn（R F）2（DMPU）2催化的芳族全氟烷基化反应，然后将其作为稳定的白色粉末从全氟烷基碘化物和二乙基锌中分离出来。全氟烷基化产品，收率优良。这种可靠，实用的催化反应的优点是：1）空气稳定且易于操作的双（全氟烷基）锌试剂可以使用； 2）该试剂具有反应性，因此无需活化剂和配体即可简单地进行操作； 3 ）不仅可以实现三氟甲基化，而且可以实现全氟烷基化。
• Copper-Catalyzed Difluoromethylation of Aryl Iodides with (Difluoromethyl)zinc Reagent
  作者：Hiroki Serizawa、Koki Ishii、Kohsuke Aikawa、Koichi Mikami

  DOI：10.1021/acs.orglett.6b01733

  日期：2016.8.5

  diethylzinc can readily lead to (difluoromethyl)zinc reagents. Therefore, the first copper-catalyzed difluoromethylation of aryl iodides with the zinc reagents is accomplished to afford the difluoromethylated arenes. The reaction proceeds efficiently through the ligand/activator-free operation without addition of ligands for copper catalyst (e.g., phen and bpy) and activators for zinc reagent (e.g., KF

  二氟碘甲烷与锌粉或二乙基锌的组合可轻易产生（二氟甲基）锌试剂。因此，完成了用锌试剂的第一铜催化的芳基碘化物的二氟甲基化，以提供二氟甲基化的芳烃。反应有效地进行通过所述配体/免费活化剂-操作不添加配体的铜催化剂（的例如，苯和联吡啶）和活化剂为锌试剂（É。克。，KF，CsF和NaO-吨-Bu）。此外，CF 2 H基团从锌试剂到铜催化剂的重金属化甚至在室温下也进行以形成铜酸盐[Cu（CF 2 H）2 ] -。
• CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME
  申请人：Samsung Display Co., Ltd.

  公开号：US20190131540A1

  公开（公告）日：2019-05-02

  Provided are a condensed cyclic compound represented by the following formulas and an organic light-emitting device including the same. The organic lightemitting device includes a first electrode; a second electrode facing the first electrode, and an organic layer between the first electrode and the second electrode, where the organic layer includes an emission layer and at least one of the condensed cyclic compound described above.

  提供了由以下公式表示的简化环状化合物和包括该化合物的有机发光器件。该有机发光器件包括第一电极；面向第一电极的第二电极，以及位于第一电极和第二电极之间的有机层，其中有机层包括发射层和上述简化环状化合物中的至少一个。
• COMPOUNDS, LIQUID COMPOSITIONS INCLUDING COMPOUNDS, AND ELECTROLUMINESCENT DEVICES
  申请人：SAMSUNG ELECTRONICS CO., LTD.

  公开号：US20220213022A1

  公开（公告）日：2022-07-07

  Provided is a compound represented by Chemical Formula 1 capable of manufacturing an EL device by inkjet printing. In Chemical Formula 1, n is an integer of greater than or equal to 3 and less than or equal to 10, X is a group represented by Chemical Formula 2 and a plurality of X's may be the same or different from each other, and Y is a group represented by Chemical Formula 3 and a plurality of Y's may be the same or different from each other.

  提供的化合物化学式为1，可以通过喷墨打印制造EL设备。在化学式1中，n是大于等于3且小于等于10的整数，X是化学式2表示的基团，多个X可能相同或不同，Y是化学式3表示的基团，多个Y可能相同或不同。
• Condensed cyclic compound and organic light-emitting device including the same
  申请人：Samsung Electronics Co., Ltd.

  公开号：US10032985B2

  公开（公告）日：2018-07-24

  A condensed cyclic compound represented by Formula 1: wherein in Formula 1, Groups X1 to X3, L11, L12, R11, and R12, and variables a11, a12, b11, b12, c11, and c12 are described in the specification.

  由式 1 表示的缩合环状化合物： 其中，在式 1 中，基团 X1 至 X3、L11、L12、R11 和 R12 以及变量 a11、a12、b11、b12、c11 和 c12 已在说明书中说明。