1-(4-iodophenyl)hexan-1-one | 160565-78-6

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 1-(4-iodophenyl)hexan-1-one
• CAS: 160565-78-6
• 化学式: C₁₂H₁₅IO
• 分子量: 302.155
• InChiKey: KEILKZSAIXATSK-UHFFFAOYSA-N

物化性质

• 熔点：
  61.8-62.7 °C(Solv: hexane (110-54-3))
• 沸点：
  339.1±25.0 °C(Predicted)
• 密度：
  1.445±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  4.2
• 重原子数：
  14
• 可旋转键数：
  5
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.42
• 拓扑面积：
  17.1
• 氢给体数：
  0
• 氢受体数：
  1

反应信息

• 作为反应物：
  描述：

  1-(4-iodophenyl)hexan-1-one 在 copper(l) iodide 、 四(三苯基膦)钯 、 palladium on carbon 、 三氟化硼乙醚 、 氢氟酸 、 氢气 、 nitrosonium tetrafluoroborate 、 三乙胺 作用下， 以 二氯甲烷 、 乙酸乙酯 、 N,N-二甲基甲酰胺 为溶剂， 生成
  参考文献：
  名称：

  Synthesis of fluorinated analogues of the immunosuppressive drug FTY720

  摘要：

  Four fluorinated derivatives of the immunosuppressive drug FTY720 were synthesized by a convergent strategy, using the Sonogashira coupling as the key reaction to assemble the two major fragments. (C) 2011 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tet.2011.02.028
• 作为产物：
  描述：

  1-(4-碘苯基)己烷-1-醇 在 草酰氯 、 二甲基亚砜 、 三乙胺 作用下， 以 二氯甲烷 为溶剂， 反应 1.0h， 以97%的产率得到1-(4-iodophenyl)hexan-1-one
  参考文献：
  名称：

  Synthesis of fluorinated analogues of the immunosuppressive drug FTY720

  摘要：

  Four fluorinated derivatives of the immunosuppressive drug FTY720 were synthesized by a convergent strategy, using the Sonogashira coupling as the key reaction to assemble the two major fragments. (C) 2011 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tet.2011.02.028

文献信息

• Synthesis and solution properties of sulfate-type hybrid surfactants with a benzene ring
  作者：Haruhiko Miyazawa、Kanako Igawa、Yukishige Kondo、Norio Yoshino

  DOI：10.1016/j.jfluchem.2003.08.007

  日期：2003.12

  molecules were synthesized. Alkanoyl chlorides were allowed to react with iodobenzene in the presence of aluminum chloride to give the corresponding aromatic ketones. The reaction of the ketones with perfluoroalkyl iodides yielded 1-[4-(perfluoroalkyl)phenyl]-1-alkanones as intermediates. The intermediates were allowed to react with methanol in tetrahydrofuran in the presence of sodium borohydride

  九种新型硫酸盐型杂化表面活性剂，C m F 2 m +1 C 6 H 4 CH（OSO 3 Na）C n H 2 n +1（F m PH n OS：m = 4，6，8; n = 3 ，5，7; C 6 H 4：p-亚苯基），在其分子中具有苯环。使烷酰氯在氯化铝的存在下与碘苯反应，得到相应的芳族酮。酮与全氟烷基碘的反应产生1- [4-（全氟烷基）苯基] -1-链烷酮作为中间体。在硼氢化钠存在下，使中间体与甲醇在四氢呋喃中反应，得到1- [4-（全氟烷基）苯基] -1-链烷醇。所需的杂化表面活性剂是通过使1- [4-（全氟烷基）苯基-1-链烷醇与三氧化硫/吡啶配合物在吡啶中反应，以及随后用氢氧化钠溶液中和产物而获得的。与常规杂化表面活性剂相比，C m F 2 m+1 C 6 H 4 COCH（SO 3 Na）C n H 2 n +1（F m H n S：m = 4，6; n = 2，4，6; C
• Direct synthesis of haloaromatics from nitroarenes <i>via</i> a sequential one-pot Mo-catalyzed reduction/Sandmeyer reaction
  作者：Raquel Hernández-Ruiz、Sara Gómez-Gil、María R. Pedrosa、Samuel Suárez-Pantiga、Roberto Sanz

  DOI：10.1039/d3ob01187a

  日期：——

  Herein, we report the direct synthesis of a wide variety of functionalized aromatic bromides, chlorides, iodides, and fluorides from nitroarenes in a sequential one-pot operation. This protocol is based on an air- and moisture-tolerant dioxomolybdenum-catalyzed reduction of nitroaromatics, employing pinacol as a reducing agent, which enables subsequent diazotization and halogenation steps. This methodology

  在此，我们报道了在连续的一锅操作中从硝基芳烃直接合成各种官能化芳香族溴化物、氯化物、碘化物和氟化物。该方案基于耐空气和耐湿气的二氧钼催化硝基芳香族化合物的还原，采用频哪醇作为还原剂，从而实现后续的重氮化和卤化步骤。该方法代表了直接从硝基芳族化合物合成卤代芳族化合物的经济、实用和替代程序。
• Synthesis of phosphate-type fluorocarbon–hydrocarbon hybrid surfactants and their adsorption onto calcium hydroxyapatite
  作者：Haruhiko Miyazawa、Hiroyuki Yokokura、Yuki Ohkubo、Yukishige Kondo、Norio Yoshino

  DOI：10.1016/j.jfluchem.2004.05.015

  日期：2004.10

  Five novel phosphate-type hybrid surfactants, CmF2m+1C6H4CH[OPO2(OC6H5)Na]CnH2n+1 (FmPHnPPhNa: m 4,6, 8; n = 3, 5), have been synthesized. When compared with sulfate-type hybrid surfactants, CmF2m+1C6H4CH(OSO3Na)CnH2n+1(C6H4 p-phenylene), the new hybrid surfactants were found to have comparable abilities to lower the surface tension of water. The critical micelle concentrations of FmPHnPPhNa followed Klevens' rule and their occupied areas per molecule increased with increasing m and n. Calcium hydroxyapatite (CaHAp) pellets modified with FmPH3PPhNa gave high hydro and lipophobic surfaces. The hybrid surfactants are expected to be useful as new dental reagents for oral hygiene. (C) 2004 Elsevier B.V. All rights reserved.
• Synthesis of fluorinated analogues of the immunosuppressive drug FTY720
  作者：Rebecca Y.Y. Ko、John C.K. Chu、Pauline Chiu

  DOI：10.1016/j.tet.2011.02.028

  日期：2011.4

  Four fluorinated derivatives of the immunosuppressive drug FTY720 were synthesized by a convergent strategy, using the Sonogashira coupling as the key reaction to assemble the two major fragments. (C) 2011 Elsevier Ltd. All rights reserved.