1-(2-全氟辛基)-乙氧基-4-羟基苯 | 193529-93-0

• 分子结构分类: 有机化合物 - 苯类化合物 - 酚类
• 中文名称: 1-(2-全氟辛基)-乙氧基-4-羟基苯
• 英文名称: 1-(2-perfluorooctyl)-ethoxy-4-hydroxybenzene
• 英文别名: 4-(2-perfluorooctyl)ethoxyphenol；4-[(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-Heptadecafluorodecyl)oxy]phenol；4-(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecoxy)phenol
• CAS: 193529-93-0
• 化学式: C₁₆H₉F₁₇O₂
• 分子量: 556.219
• InChiKey: FXVACLJOZCHIIG-UHFFFAOYSA-N

物化性质

• 沸点：
  325.6±42.0 °C(Predicted)
• 密度：
  1.573±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  7.7
• 重原子数：
  35
• 可旋转键数：
  10
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.62
• 拓扑面积：
  29.5
• 氢给体数：
  1
• 氢受体数：
  19

反应信息

• 作为反应物：
  描述：

  1-(ethoxycarbonyl)-2-vinylcyclopropanecarboxylic acid 、 1-(2-全氟辛基)-乙氧基-4-羟基苯 在 4-吡咯烷基吡啶 、 N,N'-二环己基碳二亚胺 作用下， 以 二氯甲烷 为溶剂， 反应 50.0h， 生成 2-Vinyl-cyclopropane-1,1-dicarboxylic acid ethyl ester 4-(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluoro-decyloxy)-phenyl ester
  参考文献：
  名称：

  化学变化对新型氟化聚（乙烯基环丙烷）的中间相行为的影响

  摘要：

  氟化聚合物的几个新的结构聚（1） -聚（9）由乙烯基环丙烷单体的自由基开环聚合制备的1 - 9含有的类型的不同的氟化侧基（CH 2）Ñ（CF 2）p F.在poly（1）–poly（3）中，对于固定的n = 2，p从6变为10 ，而在poly（4）–poly（6）中，在给定的p = 8时，n从3增加到5 。在poly（7）和poly（8）引入苯环以延长介晶侧基（分别为n = 2；p = 6和8），该侧基通过聚（9）中的亚甲基间隔基（m = 11）与聚合物骨架进一步分离。因此，可以评估聚合物结构的各种化学变化对中间相行为的影响。该聚合物实际上是包含1，5-直链和环丁烷环异构体单元的共聚物。无论如何，由于全氟化链的特殊性，它们形成了近晶中间相。通过增加p来提高中间相的顺序和各向同性温度（T i），但是T i随着n的增加而降低。通过插入苯环延伸侧基改善了T i。广角X射线衍射研究阐明了不同近晶

  DOI：

  10.1016/j.jfluchem.2003.07.010
• 作为产物：
  描述：

  1H,1H,2H,2H-全氟-1-癸醇 在 偶氮二甲酸二异丙酯 、 三溴化硼 、 三苯基膦 作用下， 以 四氢呋喃 、 二氯甲烷 为溶剂， 反应 24.0h， 生成 1-(2-全氟辛基)-乙氧基-4-羟基苯
  参考文献：
  名称：

  Smectic C Mesogens with Terminal Perfluoroalkyl Chains

  摘要：

  The fluorocarbon derivatives were synthesized. Liquid crystalline states were studied by DSC and microscopic observation. T-NI of those compounds were from 161.2 degrees C to 191.7 degrees C, which represented those compounds had very good liquid crystalline stability. Smectic C temperature range was 91.7 degrees C for F8H2OPMB, 54.9 degrees C for F8H2OPCB, 41.1 degrees C for F8H2OPMB-F, 36.2 degrees C for F8H2OMB, 27.4 degrees C for F8H2OPCB-F, and 10.8 degrees C for F6H2OMB. The structures of F8H2OPCB and F8H2OPCB-F at room temperature were tilted herringbone packing of two aromatic ring ester cores (smectic K phase) and perfluoroalkyl chains were located up and down alternatively. Smectic K was proved by high intensity of 003 and 004 reflections in X-ray diffraction.

  DOI：

  10.1080/15421406.2014.915634

文献信息

• Gelation of 1-Alkoxy-4-(2-Perfluoroalkyl)Ethoxybenzenes in Organic Solvents
  作者：Yuki Morita、Takeyasu Tasaka、Kosuke Kawabe、Hiroaki Okamoto、Shunsuke Takenaka、Hidetoshi Kita

  DOI：10.1080/15421400590957107

  日期：2005.6

  This paper describes preparation and physico-chemical properties of 1-alkoxy-4-(2-perfluoroalkyl)ethoxybenzenes (FmOOCn). For FmOOCn, 4-F(CF2)(m)CH2CH2O-phenyl-O-(CH2)(n)H, three homologues, m = 8 (n = 1, 2) and m = 10 (n = 1) reveal monotropic smectic A and unidentified smectic phases, respectively. Simultaneously, most of the homologous are possible to gelatinize various organic solvents such as octane, cyclohexane, DMF, ethanol, and so on. The gelation ability increases with increasing the carbon number of the perfluoroalkyl chain. The formed gel is transparent, semitransparent or opaque, and the phase transition between the gel phase and the isotropic fluid is thermally reversible. The images of gel observed with scanning electron microscope (SEM) show gathered fibrous aggregates.
• Effects of chemical variations on the mesophase behavior of new fluorinated poly(vinylcyclopropane)s
  作者：Marina Ragnoli、Elena Pucci、Massimo Bertolucci、Bernard Gallot、Giancarlo Galli

  DOI：10.1016/j.jfluchem.2003.07.010

  日期：2004.2

  Several new structures of fluorinated polymers poly(1)–poly(9) were prepared by free radical ring opening polymerization of vinylcyclopropane monomers 1–9 containing different fluorinated side groups of the type (CH2)n(CF2)pF. While in poly(1)–poly(3) p varied from 6 to 10 for a fixed n=2, in poly(4)–poly(6) n increased from 3 to 5 at the given p=8. In poly(7) and poly(8) a phenyl ring was incorporated

  氟化聚合物的几个新的结构聚（1） -聚（9）由乙烯基环丙烷单体的自由基开环聚合制备的1 - 9含有的类型的不同的氟化侧基（CH 2）Ñ（CF 2）p F.在poly（1）–poly（3）中，对于固定的n = 2，p从6变为10 ，而在poly（4）–poly（6）中，在给定的p = 8时，n从3增加到5 。在poly（7）和poly（8）引入苯环以延长介晶侧基（分别为n = 2；p = 6和8），该侧基通过聚（9）中的亚甲基间隔基（m = 11）与聚合物骨架进一步分离。因此，可以评估聚合物结构的各种化学变化对中间相行为的影响。该聚合物实际上是包含1，5-直链和环丁烷环异构体单元的共聚物。无论如何，由于全氟化链的特殊性，它们形成了近晶中间相。通过增加p来提高中间相的顺序和各向同性温度（T i），但是T i随着n的增加而降低。通过插入苯环延伸侧基改善了T i。广角X射线衍射研究阐明了不同近晶
• Smectic C Mesogens with Terminal Perfluoroalkyl Chains
  作者：Jun Yeol Jang、Young Wook Park

  DOI：10.1080/15421406.2014.915634

  日期：2015.1.2

  The fluorocarbon derivatives were synthesized. Liquid crystalline states were studied by DSC and microscopic observation. T-NI of those compounds were from 161.2 degrees C to 191.7 degrees C, which represented those compounds had very good liquid crystalline stability. Smectic C temperature range was 91.7 degrees C for F8H2OPMB, 54.9 degrees C for F8H2OPCB, 41.1 degrees C for F8H2OPMB-F, 36.2 degrees C for F8H2OMB, 27.4 degrees C for F8H2OPCB-F, and 10.8 degrees C for F6H2OMB. The structures of F8H2OPCB and F8H2OPCB-F at room temperature were tilted herringbone packing of two aromatic ring ester cores (smectic K phase) and perfluoroalkyl chains were located up and down alternatively. Smectic K was proved by high intensity of 003 and 004 reflections in X-ray diffraction.