N1,N3,N5-tris(4-methylphenyl)benzene-1,3,5-tricarboxamide | 160535-56-8

• 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: N1,N3,N5-tris(4-methylphenyl)benzene-1,3,5-tricarboxamide
• 英文别名: N,N',N''-tris(4-methylphenyl)benzene-1,3,5-tricarboxamide；N,N',N''-tris(4-methylphenyl)benzene-1,3,5-tri-carboxamide；1-N,3-N,5-N-tris(4-methylphenyl)benzene-1,3,5-tricarboxamide
• CAS: 160535-56-8
• 化学式: C₃₀H₂₇N₃O₃
• 分子量: 477.563
• InChiKey: AZFLDYUKYIBMKT-UHFFFAOYSA-N

物化性质

• 熔点：
  297-298 °C(Solv: N,N-dimethylformamide (68-12-2); water (7732-18-5))
• 沸点：
  529.1±50.0 °C(Predicted)
• 密度：
  1.273±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  5.5
• 重原子数：
  36
• 可旋转键数：
  6
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.1
• 拓扑面积：
  87.3
• 氢给体数：
  3
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  N1,N3,N5-tris(4-methylphenyl)benzene-1,3,5-tricarboxamide 在 氯化亚砜 作用下， 反应 2.0h， 生成
  参考文献：
  名称：

  Tetrazoles: LII. Synthesis of functionally substituted tetrazoles from benzene-1,3,5-tricarboxylic acid derivatives

  摘要：

  N,N',N"-Triarylbenzene-1,3,5-tricarboximidoyl chlorides reacted with sodium azide under conditions of phase-transfer catalysis to give functionally Substituted tetrazoles whose Subsequent functionalization led to complex heterocyclic structures which may be regarded as first-generation tetrazole-containing dendrimers.

  DOI：

  10.1134/s1070428008040180
• 作为产物：
  描述：

  1,3,5-苯三甲酰氯 、 乙烷,三氯氟- 在 三乙胺 作用下， 以 甲苯 为溶剂， 反应 13.0h， 以95%的产率得到N1,N3,N5-tris(4-methylphenyl)benzene-1,3,5-tricarboxamide
  参考文献：
  名称：

  荧光苯中心单，双和三三氮杂戊二烯-硼配合物† ‡

  摘要：

  合成了一系列新颖的以苯为中心的单，双和三，1,3,5-三氮杂戊二烯配体6a-e，并研究了它们对三苯基硼烷的反应性。所得的具有六元环螯合物结构的蓝色荧光硼配合物14a-e显示出出色的热稳定性和化学稳定性。所有标题化合物均已完全鉴定，包括14a–c和14e的X射线衍射研究。尽管所有三类化合物的吸收光谱相似，但荧光光谱显示出明显的差异。因此，14a，b的发射光谱显示斯托克斯位移为4100–6700 cm -1在溶液和固态中均具有较低的量子产率。但是，与14a，b相比，体积更大的化合物14c–e显示出更大的摩尔消光系数和较小的红移。对于所有化合物，与二氯甲烷溶液相比，我们观察到固态的红移荧光明显更强。为了解释吸收特性，基于DFT几何优化进行了TD-DFT研究。

  DOI：

  10.1039/c5dt00908a

文献信息

• Fluorescent benzene-centered mono-, bis- and tris-triazapentadiene–boron complexes
  作者：Christoph Glotzbach、Nadine Gödeke、Roland Fröhlich、Constantin-Gabriel Daniliuc、Shohei Saito、Shigehiro Yamaguchi、Ernst-Ulrich Würthwein

  DOI：10.1039/c5dt00908a

  日期：——

  A series of novel benzene centered mono-, bis- and tris-1,3,5-triazapentadiene ligands 6a–e was synthesized and investigated with respect to their reactivity towards triphenylborane. The resulting blue-fluorescent boron complexes 14a–e with a six-membered ring chelate structure show excellent thermal and chemical stability. All title compounds were completely characterized including X-ray diffraction

  合成了一系列新颖的以苯为中心的单，双和三，1,3,5-三氮杂戊二烯配体6a-e，并研究了它们对三苯基硼烷的反应性。所得的具有六元环螯合物结构的蓝色荧光硼配合物14a-e显示出出色的热稳定性和化学稳定性。所有标题化合物均已完全鉴定，包括14a–c和14e的X射线衍射研究。尽管所有三类化合物的吸收光谱相似，但荧光光谱显示出明显的差异。因此，14a，b的发射光谱显示斯托克斯位移为4100–6700 cm -1在溶液和固态中均具有较低的量子产率。但是，与14a，b相比，体积更大的化合物14c–e显示出更大的摩尔消光系数和较小的红移。对于所有化合物，与二氯甲烷溶液相比，我们观察到固态的红移荧光明显更强。为了解释吸收特性，基于DFT几何优化进行了TD-DFT研究。
• Films and Processes for Producing the Same
  申请人：Yamahara Motohiro

  公开号：US20090072194A1

  公开（公告）日：2009-03-19

  A birefringent film which comprises a compound having a proton-accepting group and a compound having a proton-donating group; and a birefringent film which comprises a compound having a proton-accepting group and a proton-donating group. The proton-accepting group and proton-donating group are combined with each other through intermolecular hydrogen bonding.

  一种具有质子受体基团和质子供体基团的双折射膜；以及一种包含具有质子受体基团和质子供体基团的化合物的双折射膜。质子受体基团和质子供体基团通过分子间氢键结合在一起。
• Optical Film and Method for Manufacturing the Same
  申请人：Yamahara Motohiro

  公开号：US20090104378A1

  公开（公告）日：2009-04-23

  This invention provides an optical film, which can freely regulate the tilt angle and can easily be manufactured without simultaneously regulating polymerization and mixing, and a method for manufacturing the same. The optical film is a film having birefringence. The film has been produced by association through an intermolecular hydrogen bond between at least two compounds having a refractive index anisotropy-providing structure and a proton-receptive group and at least one compound having a refractive index anisotropy-providing structure and a proton-providing group. The method for manufacturing the optical film comprises mixing at least two compounds having a refractive index anisotropy-providing structure and a proton-receptive group with at least one compound having a refractive index anisotropy-providing structure and a proton-providing group and forming a film from the mixture on an aligning film.

  这项发明提供了一种光学膜，可以自由调节倾斜角度，并且可以轻松制造，而不需要同时调节聚合和混合，以及一种制造该膜的方法。该光学膜是一种具有双折射性的膜。该膜是通过至少两种具有折射率各向异性提供结构和质子接受基团的化合物与至少一种具有折射率各向异性提供结构和质子提供基团的化合物之间的分子间氢键缔合而产生的。制造该光学膜的方法包括将至少两种具有折射率各向异性提供结构和质子接受基团的化合物与至少一种具有折射率各向异性提供结构和质子提供基团的化合物混合，并从混合物中在定向膜上形成膜。
• MONO- AND MULTI-LAYER BLOWN FILMS
  申请人：BASF SE

  公开号：EP2026965B1

  公开（公告）日：2010-09-01
• Mono-and multi-layer blown films
  申请人：Stoll Klaus

  公开号：US20090208718A1

  公开（公告）日：2009-08-20

  An extruded air cooled blown film having a) a total thickness of 5 to 500 μm, b) a mono-layer structure or 2 to 9 coextruded layers, c) at least one layer L containing a polymer selected from the group consisting of polypropylene homopolymers, polypropylene random copolymers, hetero-phasic polypropylene block copolymers, or any mixtures thereof, said polymer having a melt flow rate, according to ASTM D-1238, of 0.1 to 10 dg/min at 230° C. and 2.16 kg, said layer L further containing 0.001 to 2%, relative to the weight of the polymer, of a particular nucleating agent, and optionally d) a Modulus according to EN ISO 527 enhanced by at least 10% versus a reference film without the nucleating agent.