3-tert.-Butyl-phthalonitril | 36360-47-1

• 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: 3-tert.-Butyl-phthalonitril
• 英文别名: t-butyl-phthalonitrile；3-tert-Butylbenzene-1,2-dicarbonitrile
• CAS: 36360-47-1
• 化学式: C₁₂H₁₂N₂
• 分子量: 184.241
• InChiKey: FXLRTHLOGAMQOH-UHFFFAOYSA-N

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：
  1.0
• sp3杂化的碳原子比例：
  0.33
• 拓扑面积：
  47.6
• 氢给体数：
  0
• 氢受体数：
  2

文献信息

• N-(HETERO)ARYL-PYRROLIDINE DERIVATIVES OF PYRAZOL-4-YL-PYRROLO[2,3-d]PYRIMIDINES AND PYRROL-3-YL-PYRROLO[2,3-d]PYRIMIDINES AS JANUS KINASE INHIBITORS
  申请人：Rodgers James D.

  公开号：US20100298334A1

  公开（公告）日：2010-11-25

  The present invention relates to N-(hetero)aryl-pyrrolidine derivatives of Formula I: which are JAK inhibitors, such as selective JAK1 inhibitors, useful in the treatment of JAK-associated diseases including, for example, inflammatory and autoimmune disorders, as well as cancer.

  本发明涉及式I的N-(杂)芳基吡咯烷衍生物： 这些是JAK抑制剂，如选择性JAK1抑制剂，在治疗JAK相关疾病方面具有用处，例如炎症和自身免疫性疾病，以及癌症。
• Mu-oxo bridged heterometal compound and selective production method thereof
  申请人：ORIENT CHEMICAL INDUSTRIES, LTD.

  公开号：EP1418207A1

  公开（公告）日：2004-05-12

  An object of the present invention is to provide a new µ-oxo bridged heterometal compound, which can make the photo-functional materials to have diversified properties, and a production method such that the µ-oxo bridged heterometal compound is obtained simply, selectively and with high yield. The present invention provides µ-oxo bridged heterometal compounds, NcM1-O-M2Nc, PcM1-O-M2Nc and NcM1-O-M2Pc wherein Nc represents naphthalocyanine, Pc represents phthalocyanine, M1 represents a metal atom which is able to have a valence of up to three, and M2 represents a metal atom which is able to have a valence of four or five.

  本发明的目的是提供一种新的μ-氧桥杂金属化合物，它可以使光电功能材料具有多样化的性能，并提供一种生产方法，使μ-氧桥杂金属化合物可以简单、选择性和高产率地获得。本发明提供了μ-氧桥杂金属化合物NcM1-O-M2Nc、PcM1-O-M2Nc和NcM1-O-M2Pc，其中Nc代表萘酞菁，Pc代表酞菁，M1代表价数不超过3的金属原子，M2代表价数为4或5的金属原子。
• m-OXO CROSSLINKED DISSIMILAR METAL PHTHALOCYANINE COMPOUND AND PROCESS FOR SELECTIVELY PRODUCING THE SAME
  申请人：Orient Chemical Industries, Ltd.

  公开号：EP1514904A1

  公开（公告）日：2005-03-16

  An object of the present invention is to provide a novel µ-oxo bridged heterometal phthalocyanine compound, and a production method such that the µ-oxo bridged heterometal phthalocyanine compound is obtained simply, selectively and with high yield. The µ-oxo bridged heterometal phthalocyanine compound has a structure in which the central metal atom (M1) in a metal phthalocyanine including M1 as central metal thereof is oxo-bridged with the central metal M2 in a metal phthalocyanine including M2 as central metal thereof.

  本发明的目的是提供一种新型μ-氧桥杂金属酞菁化合物，以及一种生产方法，从而可以简单、选择性和高产率地获得μ-氧桥杂金属酞菁化合物。μ-氧桥杂金属酞菁化合物具有这样的结构：在以 M1 为中心金属的金属酞菁中，中心金属原子（M1）与以 M2 为中心金属的金属酞菁中的中心金属 M2 氧桥。
• Heterocyclic compound and organic electroluminescence device including the same
  申请人：Samsung Display Co., Ltd.

  公开号：US10741774B2

  公开（公告）日：2020-08-11

  A heterocyclic compound represented by Formula 1 and an organic electroluminescence device including the same in an emission layer. In Formula 1, Z is represented by Formula 2-1 or 2-2. In Formula 2-2, X1 to X3 are each independently CR10 or N, and at least one of X1 to X3 is N.

  一种由式 1 表示的杂环化合物和一种在发射层中包含该杂环化合物的有机电致发光器件。 在式 1 中，Z 由式 2-1 或 2-2 表示。 在式 2-2 中，X1 至 X3 各自独立地为 CR10 或 N，且 X1 至 X3 中至少有一个为 N。
• NOVEL SYNTHESIS OF PHTHALOCYANINES BY MICROWAVE IRRADIATION
  申请人：——

  公开号：US20030010621A1

  公开（公告）日：2003-01-16

  This invention provides a novel process for preparing soluble phthalocyanines by microwave irradiation in the absence of any organic solvent. Three different starting materials, i.e. t-butylphthalic anhydride, t-butyl phthalonitrile and metal-free H 2 Pc (tetra-t-butylphthalocyanine) have been adopted , respectively. The starting material with proper metal compound, such as chloride or acetate were irradiated in a commercial microwave oven for a period of 1 to 30 minutes at a power of 200˜900 W. This process is noted to reduce drastically reaction time of MPc formation from 8˜24 hours to 10˜30 minutes due to its unique heating by microwave irradiation. Sandwiched type MPc 2 (such as Lu Pc 2 ) can be produced only through metal replacement from metal-free phthalocyanine by microwave irradiation.

  本发明提供了一种在不使用任何有机溶剂的情况下通过微波辐照制备可溶性酞菁的新工 艺。三种不同的起始材料，即叔丁基邻苯二甲酸酐、叔丁基邻苯二腈和无金属 H 2 Pc （四丁基酞菁）。将起始材料与适当的金属化合物（如氯化物或醋酸盐）一起放入商用微波炉中，在 200 ˜900 W 的功率下辐照 1 至 30 分钟。夹层型 MPc 2 (如 Lu Pc 2 )只能通过微波辐照从无金属酞菁中置换金属来生成。