2-辛基苯胺 | 37413-50-6

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 中文名称: 2-辛基苯胺
• 英文名称: 2-octylaniline
• CAS: 37413-50-6
• 化学式: C₁₄H₂₃N
• 分子量: 205.343
• InChiKey: RUUWTSREEUTULQ-UHFFFAOYSA-N

物化性质

• 沸点：
  175 °C(Press: 13 Torr)
• 密度：
  0.918±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  5
• 重原子数：
  15
• 可旋转键数：
  7
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.57
• 拓扑面积：
  26
• 氢给体数：
  1
• 氢受体数：
  1

反应信息

• 作为反应物：
  描述：

  2-辛基苯胺 在 吡啶 、 盐酸-N-乙基-Nˊ-(3-二甲氨基丙基)碳二亚胺 、 sodium iodide 、 sodium hydroxide 、 lithium hydroxide 作用下， 以 四氢呋喃 、 甲醇 、 乙醇 、 二甲基亚砜 为溶剂， 反应 0.5h， 生成 (2-{4-[(2-octylphenylamino)methyl]benzoylamino}thiazol-4-yl)acetic acid
  参考文献：
  名称：

  Discovery of potent liver-selective stearoyl-CoA desaturase-1 (SCD1) inhibitors, thiazole-4-acetic acid derivatives, for the treatment of diabetes, hepatic steatosis, and obesity

  摘要：

  SCD1 is a rate-limiting enzyme in the conversion of saturated fatty acids to monounsaturated fatty acids. SCD1 inhibitors have potential effects on obesity, diabetes, acne, and cancer, but the adverse effects associated with SCD1 inhibition in the skin and eyelids are impediments to clinical development. To avoid mechanism-based adverse effects, we explored the compounds that selectively inhibit SCD1 in the liver in an ex vivo assay. Starting from a systemically active lead compound, we focused on the physicochemical properties tPSA and cLogP to minimize exposure in the off-target tissues. This effort led to the discovery of thiazole-4-acetic acid analog 48 as a potent and liver-selective SCD1 inhibitor. Compound 48 exhibited significant effects in rodent models of diabetes, hepatic steatosis, and obesity, with sufficient safety margins in a rat toxicology study with repeated dosing. (C) 2018 Elsevier Masson SAS. All rights reserved.

  DOI：

  10.1016/j.ejmech.2018.09.003
• 作为产物：
  描述：

  2-(oct-1-yn-1-yl)aniline 在 palladium on activated charcoal 、 氢气 作用下， 以 甲醇 为溶剂， 反应 24.0h， 以85%的产率得到2-辛基苯胺
  参考文献：
  名称：

  自由基/阴离子SRN1型聚合反应制备低聚芳烃

  摘要：

  自由基和阴离子：镁化iodoarenes的TEMPO介导的氧化甲提供高度立体规则性聚（米-phenylenes）通过严格交替的阴离子/自由基交叉链增长聚合。聚（米-phenylenes），平均分子量（中号Ñ高达20的）000克摩尔-1可以在温和的条件下通过该方法来制备。该方法是用于无过渡金属的聚芳烃合成的新概念。TEMPO = 2,2,6,6-四甲基哌啶-N-氧基。

  DOI：

  10.1002/anie.201206096

文献信息

• [EN] S1P RECEPTORS MODULATORS AND THEIR USE THEREOF<br/>[FR] MODULATEURS DES RÉCEPTEURS S1P ET LEUR UTILISATION
  申请人：AKAAL PHARMA PTY LTD

  公开号：WO2010043000A1

  公开（公告）日：2010-04-22

  The invention relates to novel compounds that have S1P receptor modulating activity. Further, the invention relates to a pharmaceutical comprising at least one compound of the invention for the treatment of diseases and/or conditions caused by or associated with inappropriate S1P receptor modulating activity or expression, for example, autoimmune response. A further aspect of the invention relates to the use of a pharmaceutical comprising at least one compound of the invention for the manufacture of a medicament for the treatment of diseases and/or conditions caused by or associated with inappropriate S1P receptor modulating activity or expression such as autoimmune response.

  这项发明涉及具有S1P受体调节活性的新化合物。此外，该发明涉及包括本发明中至少一种化合物的药物，用于治疗由不当的S1P受体调节活性或表达引起或相关的疾病和/或病况，例如自身免疫反应。该发明的另一个方面涉及使用包括本发明中至少一种化合物的药物制造药物，用于治疗由不当的S1P受体调节活性或表达引起或相关的疾病和/或病况，如自身免疫反应。
• Organometallic Complex, and Light-Emitting Element, Light-Emitting Device, and Electronic Device Using the Organometallic Complex
  申请人：Inoue Hideko

  公开号：US20080312437A1

  公开（公告）日：2008-12-18

  According to the present invention, a wider variation of organometallic complexes that can emit phosphorescence can be provided by applying, as a ligand, an organic compound from which a variety of derivatives can be easily synthesized. In particular, an organometallic complex having a sharp emission spectrum is provided. Further, an organometallic complex having high emission efficiency is provided. An organometallic complex represented by the general formula (G1) is provided. In the formula, Ar represents an aryl group, R represents an alkoxy group having 1 to 4 carbon atoms, and R 1 and R 2 individually represent either hydrogen or an alkyl group having 1 to 4 carbon atoms.

  根据本发明，通过应用一种作为配体的有机化合物，可以提供更广泛的能够发射磷光的有机金属配合物变体，从而可以轻松合成各种衍生物。特别地，提供了具有尖锐发射光谱的有机金属配合物。此外，提供了具有高发射效率的有机金属配合物。提供了由通式（G1）表示的有机金属配合物。在该式中，Ar代表芳基，R代表具有1至4个碳原子的烷氧基，R1和R2分别表示氢或具有1至4个碳原子的烷基。
• RESIN MODIFIER
  申请人：Kitayama Hiroaki

  公开号：US20120263883A1

  公开（公告）日：2012-10-18

  The present invention provides a resin modifier capable of obtaining a coating film having satisfactory basic performances such as antistatic properties, water resistance and transparency, a method for producing a coating film using the resin modifier, and a coating film obtained by the production method. The resin modifier of the present invention is a resin modifier represented by R 31 —O-(AO) n —SO 3 − , R 32 —OSO 3 − , or R 33 —SO 3 − and an ammonium ion that has a polymerizable unsaturated group.

  本发明提供了一种树脂改性剂，能够获得具有良好基本性能，如抗静电性能、耐水性和透明性的涂层膜，以及使用该树脂改性剂生产涂层膜的方法和通过该生产方法获得的涂层膜。本发明的树脂改性剂是由R31—O-(AO)n—SO3−、R32—OSO3−或R33—SO3−和具有聚合可不饱和基团的铵离子表示的树脂改性剂。
• Photoactive Boron–Nitrogen–Carbon Hybrids: From Azo-borazines to Polymeric Materials
  作者：Hamid Oubaha、Nicola Demitri、Joëlle Rault-Berthelot、Philippe Dubois、Olivier Coulembier、Davide Bonifazi

  DOI：10.1021/acs.joc.9b01046

  日期：2019.7.19

  In this paper, we describe synthetic routes for preparing a novel switchable BNC-based chromophore, composed of a borazine core peripherally functionalized with azobenzene moieties. Capitalizing on the Pd-catalyzed Suzuki cross-coupling reaction between a tris-triflate borazine and an organoboron azobenzene derivative, a photoswtichable azo-borazine derivative was successfully prepared. The molecule

  在本文中，我们描述了制备新型可切换的基于BNC的发色团的合成途径，该发色团由在外围被偶氮苯部分官能化的硼嗪核心组成。利用三三氟甲磺酸硼嗪与有机硼偶氮苯衍生物之间的Pd催化的Suzuki交叉偶联反应，成功制备了可光增塑的偶氮-硼嗪衍生物。分子显示出可逆的E / Z在最大的π-π*吸收特征（360 nm）的最大照射下发生光致异构化。X射线晶体学研究表明，三个偶氮苯部分的取向非平面，且-N═N-键的反式构型。基于硼嗪-偶氮苯衍生物的合成多功能性，我们使用了这种光敏支架来设计可溶性BN掺杂的聚噻吩聚合物。在不同极性的溶剂中进行的光物理表征表明该聚合物经历了分子内电荷转移（ICT）。
• Acenaphthopyridine Derivative, Material of Light-Emitting Element, Light-Emitting Element, Light-Emitting Device, and Electronic Appliance
  申请人：Takasu Takako

  公开号：US20090247753A1

  公开（公告）日：2009-10-01

  It is an object to provide a new compound which is suitable for a material of an electron-transporting layer of a light-emitting element. In particular, it is an object to provide a compound which can be used for forming a light-emitting element capable of emitting light at a low drive voltage. An acenaphthopyridine derivative represented by the following general formula (G1) is provided. In the formula, Het represents a pyridyl group or a quinolyl group.

  提供一种适用于发光元件电子传输层材料的新化合物是一个目标。特别是，提供一种可用于形成能够以低驱动电压发光的发光元件的化合物是一个目标。提供了以下一般式（G1）所代表的一种蒽醌吡啶衍生物。在该式中，Het代表吡啶基团或喹啉基团。