3-hexyl-1-methylimidazolium octylsulfate | 960314-51-6

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑类
• 英文名称: 3-hexyl-1-methylimidazolium octylsulfate
• 英文别名: 1-Hexyl-3-methylimidazol-3-ium;octyl sulfate；1-hexyl-3-methylimidazol-3-ium;octyl sulfate
• CAS: 960314-51-6
• 化学式: C₈H₁₇O₄S*C₁₀H₁₉N₂
• 分子量: 376.561
• InChiKey: WKKRNMFAZFMDBV-UHFFFAOYSA-M

计算性质

• 辛醇/水分配系数(LogP)：
  3.72
• 重原子数：
  25
• 可旋转键数：
  12
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.83
• 拓扑面积：
  83.6
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  溴己烷 以 水 为溶剂， 反应 7.0h， 生成 3-hexyl-1-methylimidazolium octylsulfate
  参考文献：
  名称：

  Aqueous-Biamphiphilic Ionic Liquid Systems: Self-Assembly and Synthesis of Gold Nanocrystals/Microplates

  摘要：

  Biamphiphilic ionic liquids (BAILs) based on 1,3-dialkylimidazolium cation and alkyl sulfate anions ([C(n)H(2n+1)mim][CmH2m+1OSO3]; n = 4, 6, or 8; m = 8, 12) have been synthesized and characterized for their self-assembling behavior in the aqueous medium. Effects of alteration of alkyl chain length in cation and anion on surfactant properties of BAILs have been examined from surface tension measurements. The effectiveness of surface tension reduction for BAILs has been found to be exceptionally higher as compared to single chain surface active ILs/conventional surfactants. The thermodynamics of the aggregation process has been studied using isothermal titration calorimetry (ITC) and temperature dependent conductivity experiments. Dynamic light scattering (DLS), nuclear magnetic resonance (NMR), and transmission electron microscopy (TEM) studies showed that BAILs formed distinct aggregated structures depending upon the amphiphilic character present in the cation and anion. BAILs ([C(n)H(2n+1)mim][CmH2m+1OSO3]) form micelles when n = 4, 6; m = 8, intermicellar aggregates when n = 4, 6; m = 12, and vesicles when n = 8; m = 8, 12. Gold nanoparticles and microplates have been synthesized in micellar and vesicle solutions of BAILs using a simple photoreduction method. The studies show the potential of BAILs for constructing micelles and supramolecular assemblies, such as bilayer vesicles, which are effective in preparation of nanomaterials of controlled size and morphology.

  DOI：

  10.1021/jp309717n

文献信息

• Further investigation of the biodegradability of imidazolium ionic liquids
  作者：Jitendra R. Harjani、Jeff Farrell、M. Teresa Garcia、Robert D. Singer、Peter J. Scammells

  DOI：10.1039/b900787c

  日期：——

  In continuation of our earlier investigations, this report presents a rationale behind the design of a series of imidazolium based ionic liquids and their biodegradation using the CO2 headspace test (ISO 14593 method, OECD 310). The effect on biodegradability of these salts through variation of the N-substituted side chains of imidazolium ions was examined further through incorporation of various functional groups and increased alkyl chain lengths. A series of anions containing moieties known to be biodegradable were also incorporated into a number of imidazolium based salts and examined in a similar fashion.

  本报告延续了我们之前的研究，介绍了一系列咪唑离子液体的设计原理，以及使用二氧化碳顶空试验（ISO 14593 方法，OECD 310）对其进行生物降解的情况。通过加入各种官能团和增加烷基链长度，进一步研究了咪唑离子 N 取代侧链的变化对这些盐类生物降解性的影响。一系列含有已知可生物降解分子的阴离子也被加入到一些咪唑盐中，并以类似的方式进行了研究。
• Aggregation of 1-alkyl-3-methylimidazolium octylsulphate ionic liquids and their interaction with Triton X-100 micelles
  作者：Khushbu Thakkar、Bhavesh Bharatiya、Vinod K. Aswal、Pratap Bahadur

  DOI：10.1039/c6ra14664c

  日期：——

  phase and aggregation behaviour of non-ionic surfactant Triton X-100 (TX-100) solution was investigated using cloud point (CP), 1H-NMR, zeta potential and scattering (DLS and SANS) techniques. These Cnmim C8SO4 ionic liquids show remarkable changes in the CP of TX-100 aqueous solutions and micelle size depending on the alkyl chain of the cation and anion. The site of Cnmim C8SO4 in TX-100 micelles was investigated

  合成了无卤表面活性和双亲性离子液体1-烷基-3-甲基咪唑鎓辛基硫酸盐（C n mim C 8 SO 4，n = 4、6、8、10 ），并使用表面张力，电导率研究了它们的水溶液行为，1 H核磁共振（1 H-NMR）和小角中子散射（SANS）。这些阳离子型表面活性剂显示出高的表面活性。SANS数据显示C 4 mim C 8 SO 4和C 6 mim C 8 SO 4在水中会形成球形和椭圆形的胶束，而具有长链咪唑阳离子（C 8 mim C 8 SO 4和C 10 mim C 8 SO 4）的胶束则表现出有限的水溶性并形成囊泡。使用浊点（CP），1 H-NMR，ζ电位和散射（DLS和DLS ）研究了这些离子液体的添加对非离子表面活性剂Triton X-100（TX-100）溶液的相和聚集行为的影响。SANS）技术。这些C n mim C 8 SO 4离子液体在TX-100水溶液的CP和胶束大小方面
• Ionic liquids
  申请人：——

  公开号：US20040262578A1

  公开（公告）日：2004-12-30

  This invention relates to novel ionic liquids with the general formula [cation] [R′—SO 4 ] in which R′ is a branched or linear, saturated or unsaturated, aliphatic or alicyclic functionalized or non-functionalized hydrocarbon chain with 3-36 carbon atoms. These novel ionic liquids can be used e.g. as solvents or solvent additives in chemical reactions, as extraction agents or as heat carriers.

  本发明涉及一种新型离子液体，其通式为[阳离子] [R′—SO4]，其中R′是具有3-36个碳原子的分支或线性、饱和或不饱和、脂肪族或环烷基的功能化或非功能化烃链。这些新型离子液体可以用作化学反应中的溶剂或溶剂添加剂、提取剂或热载体等。
• Ionic Liquids
  申请人：Wasserscheid Peter

  公开号：US20080033178A1

  公开（公告）日：2008-02-07

  Low melting ionic compounds of the general formula (cation) (R′SO 4 ) in which R′ is a branched or linear, saturated or unsaturated, aliphatic or alicyclic functionalized or non-functionalized hydrocarbon chain with 3-36 carbon atoms are provided. These compounds can serve as ionic liquids, e.g. as solvents or solvent additives in chemical reactions, as extraction agents or as heat carriers. The compounds comprise a cation and anionic sulfate ester.

  提供了一般公式为（阳离子）（R′SO4）的低熔点离子化合物，其中R′是具有3-36个碳原子的支链或线性、饱和或不饱和、脂肪族或脂环族的功能化或非功能化碳氢链。这些化合物可以作为离子液体，例如作为化学反应中的溶剂或溶剂添加剂、萃取剂或热载体。这些化合物包括一个阳离子和阴离子硫酸酯。
• ORGANISCHE SULFATE ALS IONISCHE FLÜSSIGKEITEN
  申请人：Merck Patent GmbH

  公开号：EP1425268B2

  公开（公告）日：2011-03-16