disperse orange 3 | 70734-98-4

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 偶氮苯
• 英文名称: disperse orange 3
• CAS: 70734-98-4
• 化学式: C₁₂H₁₀N₄O₂
• 分子量: 242.237
• InChiKey: UNBOSJFEZZJZLR-CCEZHUSRSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.59
• 重原子数：
  18.0
• 可旋转键数：
  3.0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  93.88
• 氢给体数：
  1.0
• 氢受体数：
  5.0

反应信息

• 作为反应物：
  描述：

  disperse orange 3 在 sodiumsulfide nonahydrate 、 sodium nitrite 作用下， 以 乙醇 、 水 为溶剂， 反应 0.75h， 生成 4-(4-azulen-1-ylazophenyl)azoaniline
  参考文献：
  名称：

  Extended aromatic π-electron conjugated dyes with three azo bonds and either one or two azulen-1-yl moieties in molecule. Synthesis and basicity

  摘要：

  Azo dyes with either one or two identical or different azulen-1-yl moieties attached to the structure -N-2-C6H4-N-2-C6H4-N-2- were prepared, the phenylene ring being either 1,3-1'3' or 1,4-1',4' disubstituted. The syntheses were accomplished in good yields via mono or bis diazotization of the corresponding anilines followed by the coupling with unsubstituted or alkyl substituted azulenes in acetic/acetate medium. The recorded electronic spectra of the synthesized compounds were analyzed and were compared with those of related compounds. The isosbestic points resulting from protonation of the azo compounds enabled pK(a) values to be determined. From these pK(a) values it is apparent that all studied compounds are very weak bases. The high solvatochromic property of the compounds with para,para-substituted phenylene groups reflects the hyperpolarizability of these compounds. (C) 2011 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.dyepig.2011.08.002
• 作为产物：
  描述：

  4-(4-硝基苯基偶氮)苯胺 以 正庚烷 为溶剂， 生成 disperse orange 3
  参考文献：
  名称：

  Rate constants of the thermal cis-trans isomerization of azobenzene dyes in solvents, acetone/water mixtures, and in microheterogeneous surfactant solutions

  摘要：

  Rate constants k(iso) of the thermal cis-trans isomerization of four 4,4'-nitro-aminoazobenzenes with different amino groups have been determined in homogeneous aprotic solvents and polyglykol oligomers, primarily by means of conventional flash photolysis. The rate constants have been correlated with polarity (according to lambda(max) from UV/Vis absorption spectra of the trans isomers) and bulk viscosity of the solvents. Qualitative conclusions about the influence of varying concentrations of water with respect to polarity and hydrogen banding on k(iso)- and lambda(max)-values in acetone/water mixtures were derived. Based on these results the data from microheterogeneous solutions have been interpreted.In microheterogeneous water/surfactant solutions k(iso)-values of selected azo dyes were strongly dependent on the concentrations of SDS, Triton(R) X-100, C12EO8 in water, and varied with the composition of bicontinuous microemulsions of Igepal(R) CA-520/ heptane/water. The large spread of isomerization rate constants is in part due to varying microviscosity.Replacement of H2O by D2O in aqueous surfactant solutions produced surprisingly large kinetic solvent isotope effects. (C) 1999 John Wiley & Sons, Inc.

  DOI：

  10.1002/(sici)1097-4601(1999)31:5<337::aid-kin3>3.0.co;2-e

文献信息

• COMPOSITIONS AND METHODS FOR DETECTING NERVE AGENTS
  申请人：Corcoran Robert C.

  公开号：US20100130757A1

  公开（公告）日：2010-05-27

  The present invention provides methods and compositions for detecting, identifying and measuring the abundance of chemical nerve agents. Methods and compositions of the present invention are capable of providing selective detection of phosphorous based nerve agents, such as nerve agents that are esters of methyl phosphonic acid derivatives incorporating a moderately good leaving group at the phosphorus. Selectivity in the present invention is provided by a sensor composition having an alpha (α) effect nucleophile group that undergoes specific nucleophilic substitution and rearrangement reactions with phosphorus based nerve agents having a tetrahederal phosphorous bound to oxygen. The present invention includes embodiments employing a sensor composition further comprising a reporter group covalently linked to the alpha effect nucleophile group allowing rapid optical readout of nerve agent detection events, including direct visual readout and optical readout via spectroscopic analysis.

  本发明提供了用于检测、识别和测量化学神经毒剂丰度的方法和组合物。本发明的方法和组合物能够选择性地检测基于磷的神经毒剂，例如酯化了在磷上具有中等良好离去基团的甲基膦酸衍生物的神经毒剂。本发明中的选择性是通过具有α效应亲核基团的传感器组合物提供的，该亲核基团与磷基神经毒剂发生特定的亲核取代和重排反应，其中磷与氧结合形成四面体磷。本发明包括采用传感器组合物的实施例，该传感器组合物进一步包括与α效应亲核基团共价连接的报告基团，允许对神经毒剂检测事件进行快速光学读数，包括直接视觉读数和通过光谱分析的光学读数。
• Azobenzene-benzoylphenylureas as photoswitchable chitin synthesis inhibitors
  作者：Xue Tian、Chao Zhang、Qi Xu、Zhong Li、Xusheng Shao

  DOI：10.1039/c6ob02813f

  日期：——

  Benzoylphenylureas (BPUs) are used as synthetic insect growth regulators for inhibiting chitin synthesis. Merging insecticidal BPUs with photoswitchable azobenzene generated photoresponsive chitin synthesis inhibitors. A prepared azobenzene-benzoylphenylurea can be activated upon irradiation with UV light, and shows 6-fold and 2-fold activity difference to armyworm (Mythimna separata) and German cockroach

  苯甲酰基苯基脲（BPU）用作合成昆虫生长调节剂，可抑制甲壳质的合成。将杀虫性BPU与可光转换的偶氮苯合并可产生光响应性几丁质合成抑制剂。制备的偶氮苯-苯甲酰基苯基脲可在紫外光照射下被活化，与粘虫（Mythimna separata）和德国蟑螂（Blattella germanica）磺酰脲受体的活性分别相差6倍和2倍。这是光可切换的BPU杀虫剂的第一个例子。这种光响应性BPU杀虫剂的产生允许通过光调节杀虫活性，并且可以促进对磺酰脲受体的时空控制和这种杀虫剂的机理研究。
• COLORING AGENTS AND METHODS OF USE THEREOF
  申请人：Living Proof, Inc.

  公开号：US20160106648A1

  公开（公告）日：2016-04-21

  Dyes, compositions comprising dyes and methods for using the same are provided.

  染料、包含染料的组合物以及使用这些染料的方法。
• Signalling Mechanisms in Anion-Responsive Push-Pull Chromophores: The Hydrogen-Bonding, Deprotonation and Anion-Exchange Chemistry of Functionalized Azo Dyes
  作者：José V. Ros-Lis、Ramón Martínez-Máñez、Félix Sancenón、Juan Soto、Knut Rurack、Hardy Weißhoff

  DOI：10.1002/ejoc.200601111

  日期：2007.5

  HSO4–, carboxylates such as acetate and benzoate and the linear anions cyanide and thiocyanate) were employed in the recognition studies. Two different effects were distinguished: (i) bathochromic shifts of <40 nm to pale orange, due to anion coordination, and (ii) strong red shifts of ca. 200 nm with a concomitant colour change to blue, due to deprotonation. This behaviour was explained as a balance between

  合成了一系列含有酰胺 (1)、尿素 (2)、硫脲 (3)、氨基甲酸酯 (4) 或氨基 (5) 氢键供体基团的偶氮染料，并研究了它们对阴离子的响应。1-5 的乙腈溶液显示亮黄色，这是由于 375-400 nm 区域的电荷转移带，受到连接到 4-硝基偶氮苯支架 4' 端的基团的电子供体强度的轻微调制。不同形状和大小的阴离子（即球形 F-、Cl-、Br- 和 I-，平面和四面体含氧阴离子如 NO3-、H2PO4- 和 HSO4-，羧酸盐如乙酸盐和苯甲酸盐以及线性阴离子氰化物和硫氰酸盐) 被用于识别研究。区分了两种不同的效果：（i）由于阴离子配位，<40 nm 的红移至浅橙色，以及（ii）约 40 nm 的强红移。由于去质子化，200 nm 伴随颜色变为蓝色。这种行为被解释为不同受体中结合位点的去质子化趋势与阴离子的质子亲和力之间的平衡。进行了半经验计算以评估阴离子和染料的氢键供体能力，并观察到与
• Water-soluble polymeric dye
  申请人：DSM IP Assets B.V.

  公开号：EP1489144A1

  公开（公告）日：2004-12-22

  The invention relates to a water-soluble polymeric dye comprising an anionic or nonionic chromophore unit covalently bound to a polymer backbone, wherein the polymer backbone is based on a water-soluble anionic or nonionic polymer and the polymer backbone comprises a) at least 2.5 anionic functional groups or at least 5 hydroxyl functional groups, or a combination thereof, per average chromophore unit for an anionic chromophore unit or b) at least 3.5 anionic functional groups or at least 7 hydroxyl functional groups, or a combination thereof, per average chromophore unit, for an nonionic chromophore unit. The polymeric dye according to the invention has good skin and fabric washability, and can be applied in paints and ink formulations for use markers and ink jet cartridges.

  该发明涉及一种水溶性聚合物染料，包括一个阴离子或非离子色团单元与聚合物骨架共价结合，其中聚合物骨架基于水溶性阴离子或非离子聚合物，且聚合物骨架包括：a）每个阴离子色团单元至少2.5个阴离子功能基或至少5个羟基功能基，或其组合，对于阴离子色团单元；或b）每个非离子色团单元至少3.5个阴离子功能基或至少7个羟基功能基，或其组合，对于非离子色团单元。根据该发明的聚合物染料具有良好的皮肤和织物可洗性，并可应用于油漆和墨水配方中，用于标记笔和喷墨打印机墨盒。

表征谱图