4,6-bis(2-pyridyl)-1,3,5-triazin-2-ol | 688753-62-0

• 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: 4,6-bis(2-pyridyl)-1,3,5-triazin-2-ol
• 英文别名: 4,6-Di-pyrid-2-yl-[1,3,5]triazin-2-ol；4,6-dipyridin-2-yl-1H-1,3,5-triazin-2-one
• CAS: 688753-62-0
• 化学式: C₁₃H₉N₅O
• 分子量: 251.247
• InChiKey: GMSCHMLJQQCKRD-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.2
• 重原子数：
  19
• 可旋转键数：
  2
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  79.6
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  4,6-bis(2-pyridyl)-1,3,5-triazin-2-ol 以 乙醇 、 水 为溶剂， 生成 Co(H2O)6*Co8(4,6-bis(2-pyridyl)-1,3,5-triazin-2-ol(1-)12(HCO3)6*24H2O
  参考文献：
  名称：

  Assembly of a Cubic Nanocage Co₈L₁₂ and a Hydrogen-Bonded 3D NbO Net Based on the [(HCO₃)₂]²⁻ Synthon and Water

  摘要：

  Two new complexes [Co(H2O)(6)subset of Co-8(L1)(12)]X-6 center dot nH(2)O (X = NO3-, n = 12 (1); X = HCO3-, n = 24, (2); HL1 = 4,6-bis(2-pyridyl)-1,3,5-triazin-2-ol) have been synthesized and characterized by single-crystal X-ray diffraction. A [Co(H2O)(6)](2+) ion is encapsuled in the central cavity of the cubelike nanocage [Co(H2O)(6)subset of Co-8(L1)(12)](6+) cation, assembled by eight cobalt ions at the corners and twelve bis-bidentate ligands L1 as the edges, via the formation of 12-fold strong hydrogen bonds between the six coordinated water molecules and the oxygen atoms of twelve L1 as a guest. Complex 1 crystallizes in a centrosymmetric space group P1, while 2 is in a very high symmetric space group Im3. In 2, a planar [(HCO3)(2)](2-) dimer motif R-2(2)(8) synthon plus six lattice water molecules constitute a planar supramolecular synthon R(20), which acts as a four connector, generating a 3D hydrogen-bonded NbO net with cubelike host cavities of similar to 20 angstrom diameter. Interestingly, the cubelike nanocage [Co(H2O)(6)subset of Co-8(L1)(12)](6+) cations fill in the cavities as templates. The magnetic properties of 1 have also been studied in the temperature range of 2-300 K, and its magnetic susceptibility obeys the Curie-Weiss law, showing antiferromagnetic coupling.

  DOI：

  10.1021/ic800585d
• 作为产物：
  描述：

  sodium;hydride 、 2-氰基吡啶 、 尿素 、 、 硫酸 在 crude product 、 甲醇 作用下， 以 二甲基亚砜 为溶剂， 反应 26.0h， 以yielding 4,6-di-pyrid-2-yl-[1 ,3,5]triazin-2-ol in the form of a white solid的产率得到4,6-bis(2-pyridyl)-1,3,5-triazin-2-ol
  参考文献：
  名称：

  Use of metal complex compounds as oxidation catalysts

  摘要：

  使用化合物公式（1）和/或（1'）[LnMemXp]zYq，[L'nMemXp]zYq作为氧化反应的催化剂，其中所有取代基在权利要求中定义，同时提供新的金属配合物和新的配体。

  公开号：

  US07612010B2

文献信息

• Use of Metal Complexes Having Bispyridylpyrimidine or Bispyridyltriazine Ligands as Catalysts for Reactions With Peroxy Compounds for Bleaching Coloured Stains on Hard Surfaces
  申请人：Wieprecht Torsten

  公开号：US20080000032A1

  公开（公告）日：2008-01-03

  The present invention relates to the use of certain manganese complexes having bispyridylpyrimidine or bispyridyltriazine ligands or mixtures of such ligands as catalysts for reactions with peroxy compounds for bleaching coloured stains on hard surfaces, especially dishes in automatic dishwashers. The invention relates also to cleaning formulations for hard surfaces comprising such catalysts.

  本发明涉及使用具有双吡啶基嘧啶或双吡啶基三嗪配体或此类配体混合物的某些锰配合物作为过氧化物反应催化剂，用于漂白硬表面上的有色污渍，特别是自动洗碗机中的餐具。本发明还涉及包含此类催化剂的硬表面清洁配方。
• Use of metal complex compounds comprising pyridine pyrimidine or s-triazine derived ligands as catalysts for oxidations with organic peroxy acids and/or precursors of organic peroxy acids and h202
  申请人：Wieprecht Torsten

  公开号：US20090189119A1

  公开（公告）日：2009-07-30

  The invention accordingly relates to the use as catalysts of at least one metal complex of formula (1) [L n Me m X p ] z Y q (1), wherein all substituents have the meanings as defined in the claims for oxidation reactions with organic peroxy acids and/or precursors of organic peroxy acid and H 2 O 2 , as well as to novel detergent compositions.

  该发明涉及使用至少一个化合物的金属配合物作为催化剂，该化合物的化学式为（1）[LnMemXp]zYq(1)，其中所有取代基的含义如权利要求所定义，用于有机过氧酸和/或有机过氧酸前体以及H2O2的氧化反应，以及新型洗涤剂组合物。
• USE OF METAL COMPLEX COMPOUNDS AS OXIDATION CATALYSTS
  申请人：Ciba Specialty Chemicals Holding Inc.

  公开号：EP1556467A1

  公开（公告）日：2005-07-27
• USE OF A COMPOSITION COMPRISING METAL COMPLEX COMPOUNDS AND POLYPHOSPHONATES AS CATALYSTS FOR OXIDATIONS
  申请人：Ciba Specialty Chemicals Holding Inc.

  公开号：EP1703977A1

  公开（公告）日：2006-09-27
• USE OF METAL COMPLEX COMPOUNDS COMPRISING PYRIDINE, PYRIMIDINE OR S-TRIAZINE DERIVED LIGANDS AS CATALYSTS FOR OXIDATIONS WITH ORGANIC PEROXY ACIDS AND/OR PRECURSORS OF ORGANIC PEROXY ACIDS AND H2O2
  申请人：Ciba Specialty Chemicals Holding Inc.

  公开号：EP1703976A2

  公开（公告）日：2006-09-27