N,N-diallyl-2,4-dinitrobenzeneamine

• 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: N,N-diallyl-2,4-dinitrobenzeneamine
• 英文别名: N,N-diallyl-2,4-dinitrobenzenamine；2,4-dinitro-N,N-bis(prop-2-enyl)aniline
• 化学式: C₁₂H₁₃N₃O₄
• 分子量: 263.253
• InChiKey: QAFDQKPIDBKMBV-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3
• 重原子数：
  19
• 可旋转键数：
  5
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.17
• 拓扑面积：
  94.9
• 氢给体数：
  0
• 氢受体数：
  5

反应信息

• 作为产物：
  描述：

  2,4-二硝基氟苯 、 二烯丙基胺 以 乙腈 为溶剂， 生成 N,N-diallyl-2,4-dinitrobenzeneamine
  参考文献：
  名称：

  Mechanistic Assessment of S_NAr Displacement of Halides from 1-Halo-2,4-dinitrobenzenes by Selected Primary and Secondary Amines: Brønsted and Mayr Analyses

  摘要：

  Pseudo-first-order rate constants (k(obsd)) have been measured spectrophotometrically for nucleophilic substitution reactions of 1-X-2,4-dinitrobenzenes (1a-d, X = F, Cl, Br, I) with various primary and secondary amines in MeCN and H2O at 25.0 +/- 0.1 degrees C. The plots of k(obsd) vs [amine] curve upward for reactions of 1a (X = F) with secondary amines in MeCN. In contrast, the corresponding plots for the other reactions of 1b-d with primary and secondary amines in MeCN and H2O are linear. The Bronsted-type plots for reactions of 1a-d with a series of secondary amines are linear with beta(nuc) = 1.00 for the reaction of 1a and 0.52 +/- 0.01 for those of 1b-d. Factors governing reaction mechanisms (e.g., solvent, halogen atoms, H-bonding interactions, amine types) have been discussed. Kinetic data were also analyzed in terms of the Mayr nucleophilicity parameter for the amines with each aromatic substrate. Provisional Mayr electrophilicity parameter (E) values for 1-X-2,4-dinitrobenzenes have been determined: E = -14.1 for X = F, E = -17.6 for X = Cl and Br, and E = -18.3 for X = I. These values are consistent with the range and order of E values for heteroaromatic superelectrophiles and normal 6-pi aromatic electrophiles.

  DOI：

  10.1021/jo301862b

文献信息

• Materials for inducing alignment in liquid crystal and liquid crystal displays
  申请人：——

  公开号：US20010039361A1

  公开（公告）日：2001-11-08

  The present invention provides novel aromatic diamines useful in preparing polyimides for optical alignment layers in liquid crystal displays. The novel compositions comprise side-chains general formula I -L 1 -D-L 2 -C f wherein D comprises 1 to 4 carbon-carbon double bonds, C f is a monovalent C 4 to C 20 fluorocarbon radical and L 1 and L 2 are linking groups.

  本发明提供了一种新型芳香二胺，用于制备液晶显示器中的光学调向层的聚酰亚胺。这种新型组合物包括侧链通式I -L 1 -D-L 2 -C f 其中D包括1至4个碳-碳双键，C f 是一种一价的C 4 至C 20 氟碳基团，L 1 和L 2 是连接基团。
• Crosslinking aromatic diamines for polyimide optical alignment layers
  申请人：——

  公开号：US06313348B1

  公开（公告）日：2001-11-06

  The invention provides novel crosslinking aromatic diamines useful in preparing polyamic acids and polyimides for optical alignment layers. The novel compositions comprise crosslinking diamines containing a C3-C20 linear or branched hydrocarbon chains containing 1 to 4 carbon-carbon double bonds.

  该发明提供了新型交联芳香二胺，可用于制备光学对准层的聚酰亚胺和聚酰胺酸。新型组合物包括交联二胺，其含有C3-C20线性或支链烃链，其中包含1至4个碳-碳双键。
• Materials for inducing alignment in liquid crystals and liquid crystal displays
  申请人：Elsicon Inc.

  公开号：US06242061B1

  公开（公告）日：2001-06-05

  The present invention provides novel polyimide, polyamic acids and esters thereof, and optical alignment layers derived therefrom, for inducing alignment of liquid crystals and liquid crystal displays. The novel compositions comprise side chain polymers of the general formula I —L1—D—L2—Cf  I wherein D comprises 1 to 4 carbon-carbon double bonds, Cf is a monovalent C4 to C20 fluorocarbon radical and L1 and L2 are linking groups. The invention further describes liquid crystal displays and other liquid crystal devices.

  本发明提供了新型聚酰亚胺、聚酰胺酸及其酯类，以及从中衍生出的光学对准层，用于诱导液晶和液晶显示器的对准。新型组合物包括通式I-L1-D-L2-Cf的侧链聚合物，其中D包括1至4个碳-碳双键，Cf是一价的C4至C20氟碳基，而L1和L2是连接基团。本发明还描述了液晶显示器和其他液晶器件。
• Processes and materials for aligning liquid crystals and liquid crystal displays
  申请人：——

  公开号：US06268460B1

  公开（公告）日：2001-07-31

  The present invention provides a process for preparing an optical alignment layer for aligning liquid crystals and liquid crystal displays comprising exposing polyimide layers with polarized light. The invention further describes optical alignment layers, liquid crystal displays incorporating optical alignment layers and novel polymer compositions within the class of polyimide, polyamic acids and esters thereof.

  本发明提供了一种制备用于调整液晶和液晶显示器的光学定向层的方法，包括使用偏振光暴露聚酰亚胺层。本发明还描述了光学定向层、包括光学定向层的液晶显示器和聚酰亚胺、聚酰胺酸和其酯类等类别中的新型聚合物组合物。
• Materials for inducing alignment of liquid crystals and liquid crystal
  申请人：Elsicon Inc.

  公开号：US06103322A1

  公开（公告）日：2000-08-15

  The present invention provides novel polyamic acids and polyimide optical alignment layers for inducing alignment of a liquid crystal medium. The novel compositions comprise crosslinking diamines containing a C.sub.3 -C.sub.20 linear or branched hydrocarbon chains containing 1 to 4 carbon-carbon double bonds. The invention further describes liquid crystal displays comprising the novel polyimide optical alignment layers.

  本发明提供了用于诱导液晶介质对齐的新型聚酰胺酸和聚酰亚胺光学对齐层。这些新型组合物包括交联二胺，其含有C.sub.3-C.sub.20线性或支链烃链，其中包含1到4个碳-碳双键。该发明还描述了包括新型聚酰亚胺光学对齐层的液晶显示器。