2,5-dihydro-2-methyl-1,3,5,5-tetraphenyl-1H-1,2,4-triazole

• 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: 2,5-dihydro-2-methyl-1,3,5,5-tetraphenyl-1H-1,2,4-triazole
• 英文别名: 1-Methyl-2,3,3,5-tetraphenyl-1,2,4-triazole
• 化学式: C₂₇H₂₃N₃
• 分子量: 389.5
• InChiKey: AJZDQEXBMZOYDY-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.4
• 重原子数：
  30
• 可旋转键数：
  4
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.07
• 拓扑面积：
  18.8
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为产物：
  描述：

  2,3-Dihydro-2,3,3,5-tetraphenyl-1H-1,2,4-triazol-1-yl 在 Pd-BaSO₄ 氢气 、 barium(II) oxide 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 生成 2,5-dihydro-2-methyl-1,3,5,5-tetraphenyl-1H-1,2,4-triazole
  参考文献：
  名称：

  Neugebauer, Franz A.; Fischer, Hans; Krieger, Claus, Angewandte Chemie, 1989, vol. 101, # 4, p. 486 - 488

  摘要：

  DOI：

文献信息

• 2,5-Dihydro-1H-1,2,4-triazol-2-yl radicals: Syntheses and properties
  作者：Franz A. Neugebauer、Hans Fischer

  DOI：10.1016/0040-4020(95)00730-v

  日期：1995.11

  A range of 2,5-dihydro-1H-1,2,4-triazol-2-yl radicals 2b-p has been prepared by dehydrogenation of the corresponding 4,5-dihydro-1H-1,2,4-triazoles 5b-p which have been synthesized using various methods. EPR, ENDOR and NMR studies have led to a complete analysis and full assignment of all hyperfine coupling constants. The pi-SOMO, having a node at the C(3) methine carbon, is mainly confined to the nitrogens of the five-membered ring, particularly to those of the hydrazyl moiety.
• NEUGEBAUER, FRANZ A.; FISCHER, HANS; KRIEDER, CLAUS, ANGEW. CHEM., 101, N4., 1989, 486-488
  作者：NEUGEBAUER, FRANZ A.、 FISCHER, HANS、 KRIEDER, CLAUS

  DOI：——

  日期：——
• Heat-Activable, Pressure-Sensitive Adhesive Mass
  申请人：Husemann Marc

  公开号：US20070287807A1

  公开（公告）日：2007-12-13

  The invention relates to a heat-activable pressure-sensitive adhesive. Provision is made for this heat-activable pressure-sensitive adhesive to comprise a polymer or copolymer formed from a monomer composition comprising at least 50% by weight of a compound of the formula CH 2 ═CH(R 1 )(COOR 2 ), wherein R 1 represents H or CH 3 and R 2 represents H or an alkyl chain having 1 to 30 carbon atoms, the polymer or copolymer having a static glass transition temperature of −10° C. to 120° C.; a temperature activation range of 15° C. or less; and a molecular weight distribution M w /M n of 2.5 or less.
• Neugebauer, Franz A.; Fischer, Hans; Krieger, Claus, Angewandte Chemie, 1989, vol. 101, # 4, p. 486 - 488
  作者：Neugebauer, Franz A.、Fischer, Hans、Krieger, Claus

  DOI：——

  日期：——