bis(trifluoromethyl)naphthalene | 64567-06-2

• 分子结构分类: 有机化合物 - 苯类化合物 - 萘
• 英文名称: bis(trifluoromethyl)naphthalene
• 英文别名: 1,2-Bis(trifluoromethyl)naphthalin；1,2-bis(trifluoromethyl)naphthalene
• CAS: 64567-06-2
• 化学式: C₁₂H₆F₆
• 分子量: 264.17
• InChiKey: STFNVLYIYHQHTQ-UHFFFAOYSA-N

物化性质

• 沸点：
  245.4±35.0 °C(Predicted)
• 密度：
  1.386±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  4.9
• 重原子数：
  18
• 可旋转键数：
  0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.17
• 拓扑面积：
  0
• 氢给体数：
  0
• 氢受体数：
  6

反应信息

• 作为产物：
  描述：

  bis(trifluoromethyl)monochloronaphthalene 生成 bis(trifluoromethyl)naphthalene
  参考文献：
  名称：

  Process for the dechlorination and/or debromination of fluorine-and

  摘要：

  含氟、氯和/或溴的芳香化合物可以通过氢气在工业上优越和选择性的方式下脱氯和/或脱溴，如果钯催化剂存在于固定相中，而芳香化合物存在于气相中。

  公开号：

  US05283378A1

文献信息

• MODIFIED POLYAROMATIC HYDROCARBONS AND POLYHETEROCYCLICS FOR OPTOELECTRONICS
  申请人：Colorado State University Research Foundation

  公开号：US20140221655A1

  公开（公告）日：2014-08-07

  The invention provides methods for substituting polyaromatic hydrocarbons or polyheterocyclic compounds with perfluoroalkyl groups. The methods can include heating a polyaromatic hydrocarbon substrate or a polyheterocyclic compound substrate in the presence of a perfluoroalkyl iodide, typically in a closed system, wherein the heating is sufficient to bring both the polyaromatic hydrocarbons or polyheterocyclic compound, and the perfluoroalkyl iodide, into the gas phase, thereby allowing the substrate to react with the perfluoroalkyl iodide in the gas phase to form polyaromatic hydrocarbons or polyheterocyclic compounds having one or more perfluoroalkyl substituents. The methods allow for the creation of versatile libraries of novel perfluoroalkyl-containing derivatives that can serve as important building blocks and active components in biomedical, electronic, and materials applications.

  本发明提供了用全氟烷基取代多芳香族烃或多杂环化合物的方法。该方法可以包括在全氟烷基碘的存在下加热多芳香族烃基底物或多杂环化合物基底物，通常在封闭系统中，其中加热足以使多芳香族烃或多杂环化合物和全氟烷基碘进入气相，从而允许底物与气相中的全氟烷基碘反应，形成具有一个或多个全氟烷基取代基的多芳香族烃或多杂环化合物。该方法允许创建多种新的含全氟烷基衍生物的多样化库，这些衍生物可以作为生物医学、电子和材料应用中的重要构建模块和活性组分。
• Copper-mediated 1,2-bis(trifluoromethylation) of arynes
  作者：Xinkan Yang、Gavin Chit Tsui

  DOI：10.1039/c8sc03754j

  日期：——

  We herein describe an unprecedented 1,2-bis(trifluoromethylation) of arynes with [CuCF3] in the presence of an oxidant DDQ. The method allows the rapid construction of a new class of 1,2-bis(trifluoromethyl)arenes in one-step from aryne precursors under mild conditions. Its synthetic utility has been demonstrated in the preparation of bis(trifluoromethylated) molecules with potential pharmaceutical

  我们在此描述了在氧化剂 DDQ 存在下，芳炔与 [CuCF 3 ]发生前所未有的 1,2-双（三氟甲基化） 。该方法允许在温和条件下从芳炔前体一步快速构建一类新的 1,2-双（三氟甲基）芳烃。其合成效用已在双（三氟甲基化）分子的制备中得到证实，具有潜在的制药和材料科学应用。机理研究表明存在邻三氟甲基芳基自由基中间体，通过CF 3基团从[CuCF 3 ]转移到芳炔。
• SINGLE-CRYSTALLINE ORGANIC CARBOXYLIC ACID METAL COMPLEX, PROCESS FOR PRODUCING THE SAME, AND USE THEREOF
  申请人：Yokohama City University

  公开号：EP1914263A1

  公开（公告）日：2008-04-23

  A large single crystal of a complex such as an organic carboxylic acid metal complex, which crystal is useful as an adsorbent of various gases and vapors of organic solvents and as a hydrogen-absorbing material, as well as a process for producing the crystal, is disclosed. Two layers wherein an upper layer thereof is constituted by a solution containing a metal salt and an organic carboxylic acid having a conjugated system, or a solution containing a metal salt of the organic carboxylic acid having a conjugated system, and wherein a lower layer of the two layers is constituted by a solvent which is not miscible with the solvent of the solution, is formed. Vapor of pyrazine or a substituted pyrazine from a solution of pyrazine or the substituted pyrazine is introduced into the upper layer to allow reaction, thereby forming a large single crystal(s) of the organic carboxylic acid metal complex at the interface between the two layers, which crystal(s) has(have) a longer side with a size of not less than 0.8 mm.

  本发明公开了一种络合物（如有机羧酸金属络合物）的大型单晶体（该晶体可用作各种气体和有机溶剂蒸汽的吸附剂以及吸氢材料）以及生产该晶体的工艺。该晶体由两层组成，其中上层由含有金属盐和具有共轭体系的有机羧酸的溶液或含有具有共轭体系的有机羧酸的金属盐的溶液构成，两层中的下层由与溶液溶剂不混溶的溶剂构成。将吡嗪或替代吡嗪溶液中的吡嗪或替代吡嗪的蒸气引入上层，使其发生反应，从而在两层之间的界面上形成有机羧酸金属络合物的大单晶体，该晶体具有尺寸不小于 0.8 毫米的长边。
• HOSOKAWA KENZO; INUKAI KAN, NIXON KAGAKU KAJSI, NIRRON KAGAKU
  作者：HOSOKAWA KENZO、 INUKAI KAN

  DOI：——

  日期：——
• Single-crystalline organic carboxylic acid metal complex, process for producing the same, and use thereof
  申请人：Takamizawa Satoshi

  公开号：US20090139401A1

  公开（公告）日：2009-06-04

  A large single crystal of a complex such as an organic carboxylic acid metal complex, which crystal is useful as an adsorbent of various gases and vapors of organic solvents and as a hydrogen-absorbing material, as well as a process for producing the crystal, is disclosed. Two layers wherein an upper layer thereof is constituted by a solution containing a metal salt and an organic carboxylic acid having a conjugated system, or a solution containing a metal salt of the organic carboxylic acid having a conjugated system, and wherein a lower layer of the two layers is constituted by a solvent which is not miscible with the solvent of the solution, is formed. Vapor of pyrazine or a substituted pyrazine from a solution of pyrazine or the substituted pyrazine is introduced into the upper layer to allow reaction, thereby forming a large single crystal(s) of the organic carboxylic acid metal complex at the interface between the two layers, which crystal(s) has (have) a longer side with a size of not less than 0.8 mm.