1-bromo-2,3,5,6-tetrafluoro-4-iodobenzene | 63108-00-9

• 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: 1-bromo-2,3,5,6-tetrafluoro-4-iodobenzene
• CAS: 63108-00-9
• 化学式: C₆BrF₄I
• 分子量: 354.868
• InChiKey: CBAIROPPSWVMEB-UHFFFAOYSA-N

物化性质

• 熔点：
  87-88 °C
• 沸点：
  220.3±35.0 °C(Predicted)
• 密度：
  2.455±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  3.7
• 重原子数：
  12
• 可旋转键数：
  0
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  0
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  1-bromo-2,3,5,6-tetrafluoro-4-iodobenzene 在 三苯基氧化膦 作用下， 以 四氢呋喃 、 正己烷 为溶剂， 反应 17.0h， 生成 (E)-1-(4-chlorophenyl)-3-(2,3,5,6-tetrafluoro-4-bromophenyl)prop-1-ene
  参考文献：
  名称：

  Dialkylzinc-mediated allylic polyfluoroarylation reaction

  摘要：

  We present an allylic polyfluoroarylation reaction with broad substrate scope and excellent functional group tolerance, using organozinc reagents under mild conditions. A catalytic amount of triphenylphosphine oxide efficiently promotes iodine-zinc exchange reaction between polyfluoroaryl iodide and dimethylzinc, and the resulting phosphine oxide-activated polyfluoroarylzinc undergoes substitution reaction with allylic halides to afford the corresponding polyfluoroarylated products. (C) 2015 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tet.2015.05.107
• 作为产物：
  描述：

  1,4-二溴四氟苯 在 正丁基锂 、 碘 作用下， 以 四氢呋喃 、 正己烷 为溶剂， 反应 1.5h， 以87%的产率得到1-bromo-2,3,5,6-tetrafluoro-4-iodobenzene
  参考文献：
  名称：

  Thermoresponsive luminescence properties of polyfluorinated bistolane-type light-emitting liquid crystals

  摘要：

  基于聚氟代双苯甲烷的热响应性发光材料已经开发出来，并发现通过施加热刺激可以实现可逆的发光开关。

  DOI：

  10.1039/c8ob01497c

文献信息

• The structural landscape of heteroaryl-2-imidazoles: competing halogen- and hydrogen-bond interactions
  作者：Christer B. Aakeröy、Tharanga K. Wijethunga、Mohammad Abul Haj、John Desper、Curtis Moore

  DOI：10.1039/c4ce00803k

  日期：——

  fifteen different halogen-bond donors. 30 of the 75 experiments resulted in the formation of co-crystals, and fifteen of these produced crystals were suitable for single-crystal X-ray diffraction analysis. A systematic analysis of the primary intermolecular interactions in these fifteen structures shows that the halogen bond is formed with the best acceptor site (as predicted by DFT molecular electrostatic

  为了检查氢键与卤素键之间的竞争，当面对带有多个潜在受体位点和一个氢键供体的探针分子时，合成了五种杂芳基-2-咪唑并随后与十五种不同的卤素键供体共结晶。75个实验中，有30个导致了共晶的形成，而这些产生的晶体中有15个适合用于单晶X射线衍射分析。
• Fluorocopolymer and process for preparing the same
  申请人：NIPPON MEKTRON, LTD.

  公开号：US20020028886A1

  公开（公告）日：2002-03-07

  Disclosed is a fluorocopolymer obtained by copolymerizing specific amounts of vinylidene fluoride, a perfluoro(lower alkyl vinyl ether), a specific fluorine compound represented by the following formula (I), a bromine-containing and/or iodine-containing vinyl monomer, and optionally, tetrafluoroethylene 1 This fluorocopolymer has a glass transition temperature of not higher than −25° C. Also disclosed is a crosslinking composition comprising the fluorocopolymer and a peroxide type crosslinking agent

  本发明公开了一种氟聚合物，它是由特定量的偏氟乙烯基、全氟（低级烷基乙烯基醚）、由下式（I）代表的特定氟化合物、含溴和/或含碘乙烯基单体以及四氟乙烯共聚而成的 1 这种含氟聚合物的玻璃化转变温度不高于 -25°C。还公开了一种交联组合物，由含氟聚合物和过氧化物型交联剂组成
• Synthesis and Characterization of Fluorinated Heterofluorene-Containing Donor−Acceptor Systems
  作者：Katharine Geramita、Yuefei Tao、Rachel A. Segalman、T. Don Tilley

  DOI：10.1021/jo902488w

  日期：2010.3.19

  A series of oligothiopheiie-perfluoro-9-heterofluorene donor-acceptor (DA) compounds was synthesized via a combination of nucleophilic aromatic substitution (SNArF) and palladium coupling reactions. These compounds are of interest as possible building blocks for materials with useful electron transport properties, since they possess relatively low LUMO energy levels of -3.3 to -3.6 eV (as determined by differential Pulse voltammetry), The HOMO-LUMO energy gaps, as determined by UV-vis spectroscopy, range between 2.4 and 2.5 eV, and photoluminescence emission spectra reveal lambda(ems) values in the range of 480-600 nm (corresponding to yellow-orange emission). Dilute solution-state photolummescence quantum yields were significantly lower than those of the pure acceptor heterofluorenes (0.02-0.38 for the DA compounds vs similar to 1 for the pure acceptors), and notable solvatochromisin in the fluorescence suggests emission from a charge-separated state. Theoretical calculations show that HOMO-level electron density is more localized on the thiophene fragment, while the LUMO level electron density is mostly associated with the electron-deficient portion of the molecule. Photovoltaic (PV) devices based on DA/poly-3-hexylthiophene (P3HT) blends exhibit improved performance over P3HT-only devices, suggesting the ability of these DA compounds to transport electrons in the solid state.
• Deacon, Glen B.; Smith, Richard N.M., Australian Journal of Chemistry, 1982, vol. 35, # 8, p. 1587 - 1597
  作者：Deacon, Glen B.、Smith, Richard N.M.

  DOI：——

  日期：——
• DEACON, G. B.;SMITH, R. N. M., AUSTRAL. J. CHEM., 1982, 35, N 8, 1587-1597
  作者：DEACON, G. B.、SMITH, R. N. M.

  DOI：——

  日期：——