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An efficient approach for the conversion of glucose into 5-hydroxymethylfurfural under continuous-flow condition 在连续流动条件下将葡萄糖转化为 5-羟甲基糠醛的高效方法
Pub Date : 2024-12-01 Epub Date: 2024-06-13 DOI: 10.1016/j.jil.2024.100101
Trinh Hao Nguyen , Nhat Minh Nguyen , Thien Phuoc Nguyen , Dao Anh Le Nguyen , Ha Bich Phan , Mai Ngoc Thi Le , Khoa Dang Nguyen , Phuong Hoang Tran

5-Hydroxymethylfurfural (HMF) has emerged as a promising link between biomass and petrochemical products, offering great potential for application and promising market prospects. In this work, we investigated the catalyst for the synthesis of 5-hydroxymethylfurfural (HMF) from glucose using metal chloride or ionic liquid bearing Brönsted and Lewis acid using the continuous flow method. Under optimal conditions, a high HMF yield of 58 % was achieved at 120 °C within 20 min using IL 2/DMSO. For the study on metal chlorides, the reaction yield reached about 43 % HMF within 60 min using AlCl3 (1 mmol) anhydrous. This research presents a remarkably effective method for synthesizing HMF.

5- 羟甲基糠醛(HMF)已成为生物质和石油化工产品之间的纽带,具有巨大的应用潜力和广阔的市场前景。在这项工作中,我们研究了利用金属氯化物或含布伦斯特酸和路易斯酸的离子液体,采用连续流动法从葡萄糖合成 5-羟甲基糠醛(HMF)的催化剂。在最佳条件下,使用 IL 2/DMSO 在 120 °C 温度下 20 分钟内实现了 58% 的 HMF 高产率。在对金属氯化物的研究中,使用无水 AlCl3(1 毫摩尔)在 60 分钟内的反应产率达到约 43%。这项研究为合成 HMF 提供了一种非常有效的方法。
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引用次数: 0
Effect of [BMIM]BF4 on corrosion of carbon steel in MEA-CO2 media BMIM]BF4 对 MEA-CO2 介质中碳钢腐蚀的影响
Pub Date : 2024-12-01 Epub Date: 2024-07-18 DOI: 10.1016/j.jil.2024.100109
Anran Zuo, Xinwei Xu, Shuna Liu, Ben Yang, Yan Su, Maosheng Jing, Yongming Tang

The corrosion behavior of carbon steel in MEA-CO2 media containing [BMIM]BF4 was investigated in this work. The IL can effectively suppress the corrosion of the steel in the solution and facilitates the activation-passivation transition of the steel in the anodic polarization. Molecular dynamics simulations show that the cationic moiety of the ILs can strong adsorb on the surface of Fe in the parallel mode. However, the high content of the IL results in the slight reduction of the passive potential range of the steel, which may be related to the anions of the IL or the free F ions. It is demonstrated that the dissociation of BF4 ions gives rise to a relatively high concentration of F ions in the solution containing [BMIM]BF4. The addition of NaF indicates the free F ions can induce the similar localized corrosion of the steel to that in the case of [BMIM]BF4.

本文研究了碳钢在含有 [BMIM]BF4 的 MEA-CO2 介质中的腐蚀行为。IL能有效抑制钢在溶液中的腐蚀,并在阳极极化过程中促进钢的活化-钝化转变。分子动力学模拟表明,IL 的阳离子分子能以平行模式强力吸附在铁表面。然而,IL 的高含量会导致钢的被动电位范围略有减小,这可能与 IL 的阴离子或游离的 F- 离子有关。研究表明,在含有 [BMIM]BF4 的溶液中,BF4- 离子的解离产生了相对较高浓度的 F- 离子。加入 NaF 表明游离 F- 离子可以诱发与 [BMIM]BF4 类似的钢局部腐蚀。
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引用次数: 0
The combination of taurine and cepharanthine as a composite antibacterial agent 牛磺酸和头花氨酸组合作为复合抗菌剂
Pub Date : 2024-12-01 Epub Date: 2024-07-20 DOI: 10.1016/j.jil.2024.100108
Qing Qing , Jumei Zeng , Xiaorui Zhang , Jiangshui Luo

The indiscriminate application of diverse broad-spectrum antimicrobials has escalated nosocomial infections into a critical global public health quandary. Currently, traditional antibiotics' efficacy against these infections becomes limited, necessitating a concerted pursuit of more efficacious antimicrobial agents. It is noteworthy that taurine (tau) and cepharanthine (cep) are both biologically active compounds, with taurine constituting a vital nutrient to human health and cepharanthine exhibiting certain antibacterial attributes. However, while cepharanthine displays intrinsic antibacterial features, its monomeric utility is constrained. This study thus investigated the formulation process of merging taurine with cepharanthine, and rigorously assessed the antimicrobial potential of the taurine-cepharanthine complex (denoted as [cep][tau]). The outcomes indicated that this complex, [cep][tau], exhibited antibacterial activity against Staphylococcus aureus and Klebsiella pneumoniae, which was on par with the efficacy of cepharanthine on its own. This observation implies that taurine did not antagonize the antibacterial potency of cepharanthine, offering novel avenues for the development of innovative pharmaceuticals targeting hospital-acquired infections.

各种广谱抗菌药物的滥用已使医院内感染升级为全球公共卫生的一大难题。目前,传统抗生素对这些感染的疗效有限,因此有必要共同寻求更有效的抗菌剂。值得注意的是,牛磺酸(tau)和头抱氨酸(cep)都是具有生物活性的化合物,其中牛磺酸是人类健康的重要营养素,而头抱氨酸则具有一定的抗菌特性。然而,虽然头花氨酸具有内在的抗菌特性,但其单体的用途却受到限制。因此,本研究调查了牛磺酸与头花氨酸的配制过程,并严格评估了牛磺酸-头花氨酸复合物(记为 [cep][tau])的抗菌潜力。结果表明,[cep][tau] 复合物对金黄色葡萄球菌和肺炎克雷伯氏菌具有抗菌活性,与单独使用头孢苋碱的效果相当。这一观察结果表明,牛磺酸不会拮抗头孢噻肟的抗菌效力,这为开发针对医院感染的创新药物提供了新的途径。
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引用次数: 0
Synthesis and characterization of absorbents based on 1-hydroxypropyl, 3-methylimidazole derivatives and sulphonated poly (ether ether ketone) 基于 1-羟基丙基、3-甲基咪唑衍生物和磺化聚(醚醚酮)的吸附剂的合成与表征
Pub Date : 2024-12-01 Epub Date: 2024-10-29 DOI: 10.1016/j.jil.2024.100122
Abdul Ghaffar Al Lafi , Atef Arfan , Jamal Alabdullah , Dalal Alnaama , Thnaa Allaf , Tasneem Alnama , Mazen Ibrahim
Adsorption is a preferred decontamination process for the treatment of industrial effluents, and various materials have been developed for this purpose. In the present work, esters based on sulfonated poly(ether ketone)/ionic liquids were prepared and their structures were evaluated by Fourier transform Infrared (FTIR) and nuclear magnetic resonance (NMR) spectroscopies. Batch adsorption experiments were carried out on a mixed solution comprising Pb2+, Cu2+, Cd2+ and Zn2+ ions with concentration ranging from 4 to 10 μg L-1. The adsorption affinity of the esters expressed as the equilibrium metal ions uptake capacity, qe (mg g-1) was in the order: Pb2+ (6.2), Cd2+ (5.1), Cu2+ (2.8) and Zn2+ (0.8). It was interesting to observe the low values of qe of all adsorbents for Zn2+, which is advantageous in the treatments of wastewater as Zn2+ present in high concentration and could reduce the ion exchange capacity of the adsorbent largely toward other metal ions pollutant. Esterification with ionic liquids open the opportunity to upcycle polymer wastes that can be sulfonated, such as polystyrene, PEEK and its cross-linked form.
吸附是处理工业废水的首选净化工艺,为此开发了各种材料。在本研究中,制备了基于磺化聚(醚酮)/离子液体的酯,并通过傅立叶变换红外光谱(FTIR)和核磁共振光谱(NMR)对其结构进行了评估。批量吸附实验在 Pb2+、Cu2+、Cd2+ 和 Zn2+ 离子的混合溶液中进行,浓度范围为 4-10 μg L-1。以平衡金属离子吸附容量 qe(毫克 g-1)表示的酯类吸附亲和力依次为Pb2+ (6.2)、Cd2+ (5.1)、Cu2+ (2.8) 和 Zn2+ (0.8)。值得注意的是,所有吸附剂对 Zn2+ 的 qe 值都很低,这对处理废水很有利,因为 Zn2+ 浓度很高,会在很大程度上降低吸附剂对其他金属离子污染物的离子交换能力。使用离子液体进行酯化处理,为聚苯乙烯、聚醚醚酮及其交联形式等可磺化的聚合物废物的回收利用提供了机会。
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引用次数: 0
Exploration of diverse interactions of nonionic poly(vinylpyrrolidone) (PVP) and anionic sodium carboxymethylcellulose (NaCMC) polymers in aqueous imidazolium-based surface active ionic liquid solutions 探索非离子聚乙烯吡咯烷酮(PVP)和阴离子羧甲基纤维素钠(NaCMC)聚合物在咪唑基表面活性离子液体水溶液中的各种相互作用
Pub Date : 2024-12-01 Epub Date: 2024-07-08 DOI: 10.1016/j.jil.2024.100106
Sangeeta Yadav , Amalendu Pal

The binding interactions in complex formation between surface active ionic liquids (SAILs) and polymers (nonionic or anionic) are gaining attention because of their potential applications in novel materials. Therefore, the use of a variety of measurements is required for a better understanding of the interactions involved in polymer/SAIL formation. Here, we have investigated the interactions of nonionic poly(vinylpyrrolidone) (PVP) and anionic sodium carboxymethylcellulose (NaCMC) polymers with SAIL 1-tetradecyl-3-methylimidazolium chloride [C14mim][Cl] in aqueous solution using different measurements such as conductivity, surface tension, fluorescence spectroscopy, dynamic light scattering (DLS) and rheometric measurements. The surface tension, conductivity and fluorescence profiles for SAIL-NaCMC systems provide distinct breakpoints that correspond to four different aggregation states: the concentration at which SAIL monomers begin to attach to the polymer chain (C1), the critical aggregation concentration C2 (cac), the saturation concentration (CS) and the critical micelle concentration (cmc). In the case of SAIL-PVP systems, the surface tension and fluorescence profiles confer three transition states: C2 (cac), CS and cmc and only two transition states have been observed in conductivity curves. The cooperative binding of SAIL to the NaCMC/PVP chain at the solution interface was analyzed by calculating various thermodynamic and interfacial parameters. Strong complexation was observed between NaCMC-SAIL molecules compared to PVP-SAIL systems at the air-solution surface. This is due to the non-ionic character of the PVP chain, which shows weak interactions with SAIL in comparison to NaCMC. Furthermore, DLS and fluorescence measurements were used to investigate the interactions between SAIL and polymers.

表面活性离子液体(SAILs)与聚合物(非离子或阴离子)之间形成复合物时的结合相互作用因其在新型材料中的潜在应用而日益受到关注。因此,为了更好地了解聚合物/SAIL 形成过程中的相互作用,需要使用各种测量方法。在此,我们采用电导率、表面张力、荧光光谱、动态光散射(DLS)和流变测量等不同测量方法,研究了水溶液中非离子聚乙烯吡咯烷酮(PVP)和阴离子羧甲基纤维素钠(NaCMC)聚合物与 SAIL 1-十四烷基-3-甲基咪唑氯化物 [C14mim][Cl] 的相互作用。SAIL-NaCMC 系统的表面张力、电导率和荧光曲线提供了与四种不同聚集状态相对应的不同断点:SAIL 单体开始附着到聚合物链上的浓度(C1)、临界聚集浓度 C2(cac)、饱和浓度(CS)和临界胶束浓度(cmc)。在 SAIL-PVP 系统中,表面张力和荧光曲线会产生三种过渡状态:C2 (cac)、CS 和 cmc,而在电导率曲线中只观察到两种过渡状态。通过计算各种热力学和界面参数,分析了 SAIL 与 NaCMC/PVP 链在溶液界面上的协同结合。与空气-溶液表面的 PVP-SAIL 系统相比,在 NaCMC-SAIL 分子之间观察到了强烈的络合。这是由于 PVP 链的非离子特性,与 NaCMC 相比,它与 SAIL 的相互作用较弱。此外,还利用 DLS 和荧光测量来研究 SAIL 与聚合物之间的相互作用。
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引用次数: 0
Direct method for microscale manipulation at liquid-liquid interfaces in ionic liquid media with real-time electron microscopy observation 利用电子显微镜实时观测离子液体介质中液-液界面微尺度操作的直接方法
Pub Date : 2024-12-01 Epub Date: 2024-10-07 DOI: 10.1016/j.jil.2024.100116
Alexey S. Kashin, Valentine P. Ananikov
A deep understanding of the processes in soft matter systems with liquid-liquid phase boundaries is of particular importance for materials science, chemistry and life sciences. A vast variety of physicochemical techniques have been proposed for the study of interfacial properties of liquid systems. Among them, electron microscopy methods occupy an important place due to the possibility of direct observation of the sample areas of interest with high spatial resolution; however, the harsh conditions of the electron microscope chamber impose significant restrictions on the possibilities of observing and manipulating unprotected liquids and related soft systems. To overcome these difficulties, in this work, we developed a methodology for direct probing of liquid-liquid interfaces with simultaneous control of the process using electron microscopy. Practically relevant liquid mixtures based on vacuum-compatible ionic liquid (IL) with water additives were probed with micrometer accuracy in real time inside an electron microscope chamber, which made it possible to reveal the role of specific ions aggregation and electrostatic phenomena in the stabilization of liquid microdomains. To test the versatility of the proposed approach, the morphology of a typical IL/water mixture was examined using a series of electron microscopes of various configurations, and it was shown that the best level of contrast between two chemically related liquid phases can be obtained in the case of a cold field emission electron source in combination with an in-lens secondary electron detector, regardless of the specific instrument manufacturer.
深入了解具有液-液相界的软物质系统的过程对于材料科学、化学和生命科学尤为重要。为研究液体系统的界面特性,人们提出了多种物理化学技术。其中,电子显微镜方法占据了重要地位,因为它可以直接观察感兴趣的样品区域,并具有很高的空间分辨率;然而,电子显微镜室的苛刻条件对观察和操作未受保护的液体和相关软系统造成了很大限制。为了克服这些困难,在这项工作中,我们开发了一种直接探测液-液界面的方法,同时利用电子显微镜对这一过程进行控制。我们在电子显微镜室内对基于真空兼容离子液体(IL)和水添加剂的实际相关液体混合物进行了微米级精度的实时探测,从而揭示了特定离子聚集和静电现象在稳定液体微域中的作用。为了测试所提议方法的通用性,使用一系列不同配置的电子显微镜对典型的IL/水混合物的形态进行了检测,结果表明,无论具体的仪器制造商是谁,冷场发射电子源与镜头内二次电子探测器相结合的方法都能获得两种化学性质相关的液相之间的最佳对比度。
{"title":"Direct method for microscale manipulation at liquid-liquid interfaces in ionic liquid media with real-time electron microscopy observation","authors":"Alexey S. Kashin,&nbsp;Valentine P. Ananikov","doi":"10.1016/j.jil.2024.100116","DOIUrl":"10.1016/j.jil.2024.100116","url":null,"abstract":"<div><div>A deep understanding of the processes in soft matter systems with liquid-liquid phase boundaries is of particular importance for materials science, chemistry and life sciences. A vast variety of physicochemical techniques have been proposed for the study of interfacial properties of liquid systems. Among them, electron microscopy methods occupy an important place due to the possibility of direct observation of the sample areas of interest with high spatial resolution; however, the harsh conditions of the electron microscope chamber impose significant restrictions on the possibilities of observing and manipulating unprotected liquids and related soft systems. To overcome these difficulties, in this work, we developed a methodology for direct probing of liquid-liquid interfaces with simultaneous control of the process using electron microscopy. Practically relevant liquid mixtures based on vacuum-compatible ionic liquid (IL) with water additives were probed with micrometer accuracy in real time inside an electron microscope chamber, which made it possible to reveal the role of specific ions aggregation and electrostatic phenomena in the stabilization of liquid microdomains. To test the versatility of the proposed approach, the morphology of a typical IL/water mixture was examined using a series of electron microscopes of various configurations, and it was shown that the best level of contrast between two chemically related liquid phases can be obtained in the case of a cold field emission electron source in combination with an in-lens secondary electron detector, regardless of the specific instrument manufacturer.</div></div>","PeriodicalId":100794,"journal":{"name":"Journal of Ionic Liquids","volume":"4 2","pages":"Article 100116"},"PeriodicalIF":0.0,"publicationDate":"2024-12-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142426253","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"OA","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Syntheses and properties of imidazopyridine-based ionic liquids 咪唑吡啶型离子液体的合成与特性
Pub Date : 2024-12-01 Epub Date: 2024-06-29 DOI: 10.1016/j.jil.2024.100100
Satoshi Kitaoka , Yuta Kitagawa , Ryo Nozoe , Kaoru Nobuoka

We have synthesized imidazopyridine-type ionic liquids and evaluated their properties. [Cnimpy][Br] (n = 4, 6, 8, 10), in which an alkyl group was introduced at the N1 position of imidazo[1,2-a]pyridine, were all solid at room temperature. Exchange of the counteranions of [Cnimpy][Br] with N(CN)2 and FSI gave the ionic liquids [Cnimpy][N(CN)2] and [Cnimpy][FSI] in the liquid state at room temperature. In particular, the DSC thermogram of [C10impy][FSI] showed a clear melting point at 22 °C. In [Cnimpy][TFSI], ionic liquids consisting of cations with short alkyl chain lengths (n = 4,6) were solids at room temperature, while those with long alkyl chain lengths (n = 8,10) were liquids. [Cnimpy][FSI] has lower viscosity than other anion-consisting ionic liquids which showed a liquid state at room temperature. [Cnimpy][FSI] has lower viscosity than other anion-containing ionic liquids. In particular, [C4impy][FSI], with its relatively short alkyl chain length, exhibited a viscosity of 101 mPa·s at 25 °C, which renders it suitable for practical applications. [C4impy] [FSI] (50 μM acetonitrile solution) showed fluorescence with maximum absorption at 336 nm. Its fluorescence wavelength was shorter than that of imidazo[1,2-a]pyridine, whereas its fluorescence quantum yield (ΦF 0.39) was higher. Therefore, it is expected to be used as a composite material by employing FRET with a substance that exhibits fluorescence in the visible region.

我们合成了咪唑吡啶型离子液体,并对其性质进行了评估。在咪唑并[1,2-a]吡啶的 N1 位引入烷基的[Cnimpy][Br](n = 4、6、8、10)在室温下均为固体。将[Cnimpy][Br]的反阴离子与 N(CN)2- 和 FSI- 交换后,离子液体[Cnimpy][N(CN)2]和[Cnimpy][FSI]在室温下呈液态。其中,[C10impy][FSI]的 DSC 热图显示其熔点明显位于 22 ℃。在[Cnimpy][TFSI]中,由短烷基链(n = 4,6)阳离子组成的离子液体在室温下为固体,而由长烷基链(n = 8,10)阳离子组成的离子液体则为液体。[Cnimpy][FSI]的粘度低于其他阴离子离子液体,它们在室温下呈液态。与其他含阴离子的离子液体相比,[Cnimpy][FSI] 的粘度较低。特别是[C4impy][FSI],其烷基链长度相对较短,在 25 °C 时的粘度为 101 mPa-s,因此适合实际应用。[C4impy] [FSI](50 μM 乙腈溶液)在 336 纳米波长处显示出最大吸收荧光。其荧光波长比咪唑并[1,2-a]吡啶短,而荧光量子产率(ΦF 0.39)却更高。因此,通过与在可见光区域发出荧光的物质进行 FRET,它有望用作一种复合材料。
{"title":"Syntheses and properties of imidazopyridine-based ionic liquids","authors":"Satoshi Kitaoka ,&nbsp;Yuta Kitagawa ,&nbsp;Ryo Nozoe ,&nbsp;Kaoru Nobuoka","doi":"10.1016/j.jil.2024.100100","DOIUrl":"https://doi.org/10.1016/j.jil.2024.100100","url":null,"abstract":"<div><p>We have synthesized imidazopyridine-type ionic liquids and evaluated their properties. [C<sub>n</sub>impy][Br] (<em>n</em> = 4, 6, 8, 10), in which an alkyl group was introduced at the N<sub>1</sub> position of imidazo[1,2-<em>a</em>]pyridine, were all solid at room temperature. Exchange of the counteranions of [C<sub>n</sub>impy][Br] with N(CN)<sub>2</sub><sup>−</sup> and FSI<sup>−</sup> gave the ionic liquids [C<sub>n</sub>impy][N(CN)<sub>2</sub>] and [C<sub>n</sub>impy][FSI] in the liquid state at room temperature. In particular, the DSC thermogram of [C<sub>10</sub>impy][FSI] showed a clear melting point at 22 °C. In [C<sub>n</sub>impy][TFSI], ionic liquids consisting of cations with short alkyl chain lengths (<em>n</em> = 4,6) were solids at room temperature, while those with long alkyl chain lengths (<em>n</em> = 8,10) were liquids. [C<sub>n</sub>impy][FSI] has lower viscosity than other anion-consisting ionic liquids which showed a liquid state at room temperature. [C<sub>n</sub>impy][FSI] has lower viscosity than other anion-containing ionic liquids. In particular, [C<sub>4</sub>impy][FSI], with its relatively short alkyl chain length, exhibited a viscosity of 101 mPa·s at 25 °C, which renders it suitable for practical applications. [C<sub>4</sub>impy] [FSI] (50 μM acetonitrile solution) showed fluorescence with maximum absorption at 336 nm. Its fluorescence wavelength was shorter than that of imidazo[1,2-<em>a</em>]pyridine, whereas its fluorescence quantum yield (Φ<sub>F</sub> 0.39) was higher. Therefore, it is expected to be used as a composite material by employing FRET with a substance that exhibits fluorescence in the visible region.</p></div>","PeriodicalId":100794,"journal":{"name":"Journal of Ionic Liquids","volume":"4 2","pages":"Article 100100"},"PeriodicalIF":0.0,"publicationDate":"2024-12-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://www.sciencedirect.com/science/article/pii/S2772422024000235/pdfft?md5=ab9bddacb134caad67bbd46da7d3ea4f&pid=1-s2.0-S2772422024000235-main.pdf","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"141540483","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"OA","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Mesoporous silica supported ionic liquid materials with high efficacy for CO2 adsorption studies 用于二氧化碳吸附研究的高效介孔二氧化硅支撑离子液体材料
Pub Date : 2024-12-01 Epub Date: 2024-06-25 DOI: 10.1016/j.jil.2024.100102
Divya Jadav , Madhu Pandey , Amit K. Bhojani , Tareq W.M. Amen , Nao Tsunoji , Dheeraj K. Singh , Mahuya Bandyopadhyay

CO2 capture from industrial processes and power plants, contribute to curbing global warming and advancing sustainability efforts. This study involves the design and synthesis of novel mesoporous silica supported ionic liquid based adsorbents for carbon dioxide capture. Utilization of MSILs delves into the efficiency and mechanisms of CO2 adsorption, offering insights for sustainable carbon capture technologies in combating greenhouse gas emissions. 1-ethyl-3-methylimidazolium tetrafluoroborate, 1-ethyl-3-methylimidazolium ethyl sulfate and 1-ethyl-3-methylimidazolium methylsulfate ionic liquids were anchored on the surface of mesoporous silica which then led to highly efficient adsorbent material. Simple, efficient and cost saving methodology was performed to synthesize such highly efficient CO2 adsorbent materials. In addition, we theoretically predicted the favorable interaction mechanism of chosen molecular entities for CO2 adsorption using density functional theory (DFT) analysis. Theoretical results depict the strong interaction of molecular entities with CO2 gas molecules which is clearly evident from the experimental findings.

从工业流程和发电厂中捕获二氧化碳有助于遏制全球变暖和推进可持续发展。本研究涉及设计和合成新型介孔二氧化硅离子液体吸附剂,用于二氧化碳捕集。利用 MSILs 研究二氧化碳的吸附效率和机理,为采用可持续碳捕获技术应对温室气体排放提供启示。1-ethyl-3-methylimidazolium tetrafluoroborate、1-ethyl-3-methylimidazolium ethyl sulfate 和 1-ethyl-3-methylimidazolium methylsulfate 离子液体被锚定在介孔二氧化硅表面,从而形成了高效的吸附材料。我们采用简单、高效和节约成本的方法合成了这种高效的二氧化碳吸附材料。此外,我们还利用密度泛函理论(DFT)分析从理论上预测了所选分子实体对二氧化碳吸附的有利相互作用机制。理论结果表明,分子实体与二氧化碳气体分子之间具有很强的相互作用,这一点从实验结果中可以清楚地看出。
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引用次数: 0
Designing dicationic organic salts and ionic liquids exhibiting high fluorescence in the solid state 设计在固态下显示高荧光的二阳离子有机盐和离子液体
Pub Date : 2024-12-01 Epub Date: 2024-11-09 DOI: 10.1016/j.jil.2024.100125
David King, Matthew C. Le, Yan P. Arnaiz, Seonghyeok L. Cox, Jakob Smith, Haesook Han, Pradip K. Bhowmik
Dicationic ionic liquids (DILs) are emerging as a powerful, next-generation approach to designing applied ILs because of their superior physicochemical properties as well as their diverse complexity and tunability for task specific applications. DILs are scarce in the literature compared to monocationic ILs (MILs), and one of their main issues is their expected tendency to possess higher melting temperatures. A series of 1,4-bis[2-(4-pyridyl)ethenyl]benzene and 1,4-bis[2-(2-pyridyl)ethenyl]benzene quaternary salts (Q-BPEBs) with different counterions (bromide, tosylate, and triflimide) and carbon chain lengths (C6, C9, and C12) have been synthesized for their potential as DILs with strong photoluminescent properties in the solid state. All Q-BPEB salts demonstrated robust thermal stabilities as determined by thermogravimetric analysis (TGA). The differential scanning calorimetry (DSC) thermograms for Q-BPEB tosylates and triflimides displayed crystalline polymorphisms before melting transitions as verified by polarizing optical microscopy (POM). The Q-BPEB bromide and tosylate salts all showed high melting points of above >170 °C because of their dicationic rigid structures and strong ionic interactions of their anions. Once the Q-BPEB tosylates were exchanged with triflimide ions, para- isomers 1aTf2N, 1bTf2N, 1bTfand 2N,and 1cTf2N still possessed very high melting points (>225 °C), however, the ortho- isomers 2aTf2N, 2bTf2N, and 2cTf2N exhibited melting points lower than 100 °C, classifying them as DILs. Their photoluminescent properties were also studied in methanol with the emission values of λem = 476–482 nm for the para- isomers and those of λem = 448–453 nm for the ortho- isomers. In the solid state, the Q-BPEB salts exhibited strong fluorescence with quantum yields of up to 50 %. The relatively simple synthesis of these fluorescent dicationic organic salts and ILs are pertinent towards the scarcity of these materials in the literature and provide a deeper insight on the design of fluorescent ILs containing more than one charge center.
双阳离子离子液体(DILs)因其优越的物理化学特性以及针对特定任务应用的多种复杂性和可调性,正在成为设计应用型离子液体的一种强大的下一代方法。与单配ILs(MILs)相比,DILs在文献中很少见,其主要问题之一是它们预计会具有较高的熔化温度。我们合成了一系列 1,4-双[2-(4-吡啶基)乙烯基]苯和 1,4-双[2-(2-吡啶基)乙烯基]苯的季盐(Q-BPEBs),它们具有不同的反离子(溴化物、甲苯磺酸盐和三亚甲基磺酸盐)和碳链长度(C6、C9 和 C12),具有作为 DIL 的潜力,在固态下具有很强的光致发光特性。通过热重分析(TGA)测定,所有 Q-BPEB 盐均具有很强的热稳定性。经偏振光学显微镜(POM)验证,Q-BPEB 对甲苯磺酸盐和三亚甲基溴的差示扫描量热法(DSC)热图在熔化转变之前显示出结晶多态性。由于 Q-BPEB 溴化物和对甲苯磺酸盐具有二阳离子刚性结构,且阴离子具有很强的离子相互作用,因此它们的熔点都高于 170 °C。将 Q-BPEB 对甲苯磺酸盐与三亚甲基溴离子交换后,对位异构体 1aTf2N、1bTf2N、1bTfand 2N 和 1cTf2N 仍具有很高的熔点(225 °C),但正交异构体 2aTf2N、2bTf2N 和 2cTf2N 的熔点低于 100 °C,因此被归类为 DIL。还研究了它们在甲醇中的光致发光特性,对位异构体的发射值为 λem = 476-482 nm,正位异构体的发射值为 λem = 448-453 nm。在固态下,Q-BPEB 盐显示出强烈的荧光,量子产率高达 50%。这些荧光二阳离子有机盐和IL的合成相对简单,这与这些材料在文献中的稀缺性有关,并为设计含有一个以上电荷中心的荧光IL提供了更深入的见解。
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引用次数: 0
Second law of thermodynamics, heat transfer, and pumping power analyses of water and ionic liquid mixture based MXene nanofluids in a shell and helical coil heat exchanger 壳螺旋盘管热交换器中基于水和离子液体混合物的 MXene 纳米流体的热力学第二定律、传热和泵功率分析
Pub Date : 2024-12-01 Epub Date: 2024-10-17 DOI: 10.1016/j.jil.2024.100118
L.S. Sundar, Sérgio M.O. Tavares, António M.B. Pereira, Antonio C.M. Sousa
Heat exchangers are extensively employed across diverse sectors for efficient thermal (heat)transfer between two fluids, specifically from a hot fluid to a cold fluid. Nanofluids are promising heat transfer fluids that exhibit exceptional thermal performance in heat exchangers. The present study examines the thermodynamic second law efficiency analysis of a shell and helical coil heat exchanger utilizing MXene/80:20% water+[MMIM][DMP] (mass percentage) based ionanofluids. An analytical investigation was conducted on the heat transfer coefficient, entropy generation rate, and exergy efficiency of a shell and helical coil heat exchanger, considering particle weight loadings from 0.2% to 1.0%, Reynolds numbers from 500 to 4300, and flow rates from 0.5 to 3.5 L/min. In the base fluid, at 1.0 wt.% and at a Reynolds number of 3598, the increase in heat transfer, Nusselt number, friction factor, pressure drop, effectiveness, and frictional entropy generation are 45.59%, 28.27%, 15.19%, 12.56%, 17.20%, and 16.21%, respectively. Concurrently, thermal entropy generation, and total exergy destruction were reduced by 46.23% and 20.08%, respectively. The second law (exergy) efficiency and thermal performance factor are improved by 34.04% and 1.384-times, respectively, at 1.0 wt.% and at a Reynolds number of 3598, compared to the base fluid. The data from the current study is corroborated by existing literature. New correlations were developed from the computed data points to estimate the Nusselt number and friction factor.
各行各业都广泛使用热交换器来实现两种流体之间的高效热(热)传递,特别是从热流体到冷流体。纳米流体是一种前景广阔的传热流体,在热交换器中表现出卓越的热性能。本研究对使用 MXene/80:20% 水+[MMIM][DMP](质量百分比)离子流体的壳式螺旋盘管热交换器进行了热力学第二定律效率分析。考虑到颗粒重量负载从 0.2% 到 1.0%,雷诺数从 500 到 4300,流速从 0.5 到 3.5 L/min,对壳体和螺旋盘管热交换器的传热系数、熵产生率和放能效率进行了分析研究。在基础流体中,当颗粒重量为 1.0%、雷诺数为 3598 时,传热系数、努塞尔特数、摩擦因数、压降、效率和摩擦生熵分别增加了 45.59%、28.27%、15.19%、12.56%、17.20% 和 16.21%。同时,产生的热熵和破坏的总放热量分别减少了 46.23% 和 20.08%。与基础流体相比,在 1.0 wt.%、雷诺数为 3598 时,第二定律(放能)效率和热性能系数分别提高了 34.04% 和 1.384 倍。本次研究的数据得到了现有文献的证实。根据计算的数据点建立了新的相关关系,以估算努塞尔特数和摩擦因数。
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Journal of Ionic Liquids
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