4-(hexyloxy)anilinium chloride | 57666-61-2

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯酚醚
• 英文名称: 4-(hexyloxy)anilinium chloride
• 英文别名: 4-(Hexyloxy)aniline hydrochloride；4-hexoxyaniline;hydrochloride
• CAS: 57666-61-2
• 化学式: C₁₂H₁₉NO*ClH
• 分子量: 229.75
• InChiKey: WPHKVGUZCCBDGB-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -0.48
• 重原子数：
  15
• 可旋转键数：
  6
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.5
• 拓扑面积：
  36.9
• 氢给体数：
  1
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  4-(hexyloxy)anilinium chloride 在 盐酸 、 potassium carbonate 、 sodium nitrite 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 反应 72.0h， 生成 {4-[(4-hexyloxyphenyl)diazenyl]phenoxy}acetonitrile
  参考文献：
  名称：

  Synthesis, mesomorphic and dielectric properties of 4-(cyanomethoxy)phenyl 4-alkoxybenzoates, 4-(cyanomethoxy)-4′-alkoxyazo- and -azoxybenzenes

  摘要：

  Preparation methods were developed for homologs of 4-(cyanomethoxy)phenyl 4-alkoxybenzoates (C-7, C-8, C-9), 4-(cyanomethoxy)-4'-alkoxyazo (C-2, C-3, C-6), -azoxybenzenes (C-3, C-6) whose composition and structure were proved by elemental analysis and H-1 NMR spectra. 4-(Cyanomethoxy) group destabilizes the mesophase, consequently, only four among the compounds obtained exhibit the thermotropic nematic mesomorphism.

  DOI：

  10.1134/s1070428014050017
• 作为产物：
  描述：

  4-庚氧基苯胺 在 硫酸 、 sodium chloride 作用下， 以 乙醚 为溶剂， 以93 %的产率得到4-(hexyloxy)anilinium chloride
  参考文献：
  名称：

  标记的、靶向癌症的 DNA 适体的氢诱导极化

  摘要：

  我们通过对氢展示了癌症靶向适体 AS1411 前所未有的超极化。为此，我们筛选了合适的对位氢诱导极化 (PHIP) 标记，进行固相合成以将标记整合到 AS1411 中，并通过聚乙二醇化调整 DNA 的极性，以在不影响规范核苷酸的情况下在有机溶剂中实现高效、选择性氢化。

  DOI：

  10.1002/anie.202300531

文献信息

• Synthesis and in vitro antifungal activity of 4-substituted phenylguanidinium salts
  作者：Gabriela Braunerová、Vladimír Buchta、Luis Silva、Jiří Kuneš、Karel Palát

  DOI：10.1016/j.farmac.2004.03.001

  日期：2004.6

  A series of 4-substituted phenylguanidinium derivatives was synthesized and its antimicrobial activity was evaluated in vitro against eight potentially pathogenic strains of fungi.
• Griffin, A. C.; Vaidya, S. R., Molecular Crystals and Liquid Crystals (1969-1991), 1989, vol. 173, p. 85 - 88
  作者：Griffin, A. C.、Vaidya, S. R.

  DOI：——

  日期：——
• High-Density Noncovalent Functionalization of DNA by Electrostatic Interactions
  作者：Wei Chen、Jennifer Y. Gerasimov、Pei Zhao、Kai Liu、Andreas Herrmann

  DOI：10.1021/jacs.5b05432

  日期：2015.10.14

  Preserving DNA hybridization in organic solvents could someday serve to significantly extend the applicability of DNA-based technologies. Here, we present a method that can be used to solubilize double-stranded DNA at high concentrations in organic media. This method requires first precipitating a DNA molecule from the aqueous environment with an anilinium derivative and subsequently exchanging this moiety with an amine-containing surfactant in organic solvent. We demonstrate that this method yields complete exchange of the surfactant and allows for the modification of DNA with hydrophobic primary, secondary, and tertiary alkylamines and ordered functional lcsystems. Using this approach, we fabricate a multichromophoric light harvesting system that would be unattainable by traditional methods. Additionally, this method makes it possible to use small, hydrophilic molecules to solubilize DNA in organic solvents, which reduces the shielding around the macromolecule more accessible for further chemical modification. We believe that this approach will prove beneficial in expanding the scope of DNA-based nano- and biotechnologies. DNA and makes the tremendously