苯酚,2-(4-氨基-6-乙氧基-1,3,5-三嗪-2-基)- | 140475-13-4

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 三嗪类
• 中文名称: 苯酚,2-(4-氨基-6-乙氧基-1,3,5-三嗪-2-基)-
• 英文名称: 2-o-hydroxyphenyl-4-amino-6-ethoxy-1,3,5-triazene
• 英文别名: 2-o-hydroxyphenyl-4-amino-6-ethoxy-1,3,5-triazine；2-(4-Amino-6-ethoxy-1,3,5-triazin-2-yl)phenol
• CAS: 140475-13-4
• 化学式: C₁₁H₁₂N₄O₂
• 分子量: 232.242
• InChiKey: XVTYYVFBFYZPQR-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.2
• 重原子数：
  17
• 可旋转键数：
  3
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.18
• 拓扑面积：
  94.2
• 氢给体数：
  2
• 氢受体数：
  6

反应信息

• 作为反应物：
  描述：

  nickel(II) chloride hexahydrate 、 苯酚,2-(4-氨基-6-乙氧基-1,3,5-三嗪-2-基)- 以 乙醇 为溶剂， 生成 Nickel, bis[2-(4-amino-6-ethoxy-1,3,5-triazin-2-yl)phenolato]-
  参考文献：
  名称：

  Santra, Swapna; Saha, Chitta R; Santra, P K, Indian Journal of Chemistry, Section A: Inorganic, Physical, Theoretical and Analytical, 1992, vol. 31, # 3, p. 160 - 165

  摘要：

  DOI：
• 作为产物：
  描述：

  2-(4-Amino-6-ethoxy-1,2-dihydro-[1,3,5]triazin-2-yl)-phenol 在 palladium on activated charcoal 、 4-异丙基甲苯 作用下， 生成 苯酚,2-(4-氨基-6-乙氧基-1,3,5-三嗪-2-基)-
  参考文献：
  名称：

  Santra, Swapna; Saha, Chitta R; Santra, P K, Indian Journal of Chemistry, Section A: Inorganic, Physical, Theoretical and Analytical, 1992, vol. 31, # 3, p. 160 - 165

  摘要：

  DOI：

文献信息

• Dihydrogen Reduction of Nitroarmatics, Alkenes, Alkynes, Benzaldehyde, and Benzil by Newly Synthesized Rh(I) Complexes in Homogeneous Phase
  作者：Priyanka Sagar、Varsha Rani

  DOI：10.1080/15533174.2010.522539

  日期：2010.11.30

  Rh(I) complexes of S-triazines and azobenzene were found to be very efficient towards the catalytic hydrogenation of alkenes, alkynes at normal pressure, and at room temperature. Reduction of aromatic nitrocompounds, benzaldehyde, and benzil were observed in appreciable amounts only at high pressure and at high temperature. No diminished catalytic activity was observed even after 6–8 repeated catalytic

  发现在常压和室温下，S-三嗪和偶氮苯的Rh（I）络合物对于烯烃，炔烃的催化加氢非常有效。仅在高压和高温下才观察到相当数量的芳香族硝基化合物，苯甲醛和苯甲酰还原。即使经过6-8次重复的催化运行，也没有观察到催化活性降低。在正常和高压条件下，观察到在存在额外配体的情况下对还原速率的深刻影响，而没有影响产率的性质。研究了动力学。提出了机理并推导了速率方程。
• Sagar, Priyanka; Sharma, Varsha; Kumar, Rohit, Journal of the Indian Chemical Society, 2012, vol. 89, # 2, p. 139 - 145
  作者：Sagar, Priyanka、Sharma, Varsha、Kumar, Rohit

  DOI：——

  日期：——
• Dihydrogen reduction of nitroaromatics, alkenes, alkynes using Pd(II) complexes both in normal and high pressure conditions
  作者：P.K. Santra、Priyanka Sagar

  DOI：10.1016/s1381-1169(02)00600-3

  日期：2003.4

  Pd(II) complexes of S-Triazines and anthranilic acid were found very efficient towards the catalytic hydrogenation of organic nitrocompounds, alkenes, alkynes, etc. No diminished catalytic activity was observed even after 6-8 repeated catalytic runs. Profound effect on the rate of reduction and nature of yield were observed in presence of extra ligand. Kinetics were studied. Mechanism has been proposed and rate equation has been derived. (C) 2002 Elsevier Science B.V. All rights reserved.