Structural peculiarities of new benzopyrylium dyes: X-ray, FT-IR, and DFT complex study

In this study, the SO42-/TiO2-La2O3-Fe2O3 catalyst was prepared and tested in the conversion of fructose to ethyl levulinate . The catalyst was characterized from the point of view of the textural analysis, FT-IR analysis, acid strength distribution, X-ray powder diffraction and pyridine adsorption IR spectra. The influence of the reaction parameters on the ethyl levulinate yield was study. The maximum yield of 37.95% in levulinate esters was obtained at 180 �C, 2 g catalyst and 4 h reaction time. The effect of ethyl levulinate addition to diesel-biodiesel blend in different rates, i.e, 0.5, 1, 2.5, 5 (w.t %) on density, kinematic viscosity and flash point was evaluated and compared with the European specification.

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Thermal Behaviour of Candesartan Active substance and in pharmaceutical compounds

Revista de Chimie ◽

10.37358/rc.17.8.5787 ◽

2017 ◽

Vol 68 (8) ◽

pp. 1895-1902

Author(s):

Ioana Cristina Tita ◽

Eleonora Marian ◽

Bogdan Tita ◽

Claudia Crina Toma ◽

Laura Vicas

Keyword(s):

Thermal Behaviour ◽

Active Substance ◽

Pharmaceutical Research ◽

Pharmaceutical Product ◽

Nitrogen Atmosphere ◽

Pure Substance ◽

Scanning Calorimetry ◽

X Ray ◽

Ft Ir

Thermal analysis is one of the most frequently used instrumental techniques in the pharmaceutical research, for the thermal characterization of different materials from solids to semi-solids, which are of pharmaceutical relevance. In this paper, simultaneous thermogravimetry/derivative thermogravimetry (TG/DTG) and differential scanning calorimetry (DSC) were used for characterization of the thermal behaviour of candesartan cilexetil � active substance (C-AS) under dynamic nitrogen atmosphere and nonisothermal conditions, in comparison with pharmaceutical product containing the corresponding active substance. It was observed that the commercial samples showed a different thermal profile than the standard sample, caused by the presence of excipients in the pharmaceutical product and to possible interaction of these with the active substance. The Fourier transformed infrared spectroscopy (FT-IR) and X-ray powder diffraction (XRPD) were used as complementary techniques adequately implement and assist in interpretation of the thermal results. The main conclusion of this comparative study was that the TG/DTG and DSC curves, together with the FT-IR spectra, respectively X-ray difractograms constitute believe data for the discrimination between the pure substance and pharmaceutical forms.

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Enhancement of Chloroprene/Natural/Butadiene Rubber Nanocomposite Properties Using Organoclays and Their Combination with Carbon Black as Fillers

Polymers ◽

10.3390/polym13071085 ◽

2021 ◽

Vol 13 (7) ◽

pp. 1085

Author(s):

Patricia Castaño-Rivera ◽

Isabel Calle-Holguín ◽

Johanna Castaño ◽

Gustavo Cabrera-Barjas ◽

Karen Galvez-Garrido ◽

...

Keyword(s):

Mechanical Properties ◽

Carbon Black ◽

High Performance ◽

Rubber Matrix ◽

Butadiene Rubber ◽

X Ray Diffraction ◽

X Ray ◽

Rubber Blends ◽

Ft Ir ◽

Chloroprene Rubber

Organoclay nanoparticles (Cloisite® C10A, Cloisite® C15) and their combination with carbon black (N330) were studied as fillers in chloroprene/natural/butadiene rubber blends to prepare nanocomposites. The effect of filler type and load on the physical mechanical properties of nanocomposites was determined and correlated with its structure, compatibility and cure properties using Fourier Transformed Infrared (FT-IR), X-ray Diffraction (XRD), Thermogravimetric Analysis (TGA) and rheometric analysis. Physical mechanical properties were improved by organoclays at 5–7 phr. Nanocomposites with organoclays exhibited a remarkable increase up to 46% in abrasion resistance. The improvement in properties was attributed to good organoclay dispersion in the rubber matrix and to the compatibility between them and the chloroprene rubber. Carbon black at a 40 phr load was not the optimal concentration to interact with organoclays. The present study confirmed that organoclays can be a reinforcing filler for high performance applications in rubber nanocomposites.

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Release of toxic methylene blue from water by mesoporous silicalite-1: characterization, kinetics and isotherm studies

Applied Water Science ◽

10.1007/s13201-021-01435-z ◽

2021 ◽

Vol 11 (7) ◽

Author(s):

Sabarish Radoor ◽

Jasila Karayil ◽

Aswathy Jayakumar ◽

Jyotishkumar Parameswaranpillai ◽

Suchart Siengchin

Keyword(s):

Electron Microscopy ◽

Contact Time ◽

Dye Removal ◽

Batch Adsorption ◽

Aqueous Environment ◽

Order Kinetic ◽

Adsorption Method ◽

X Ray ◽

Ft Ir ◽

Adsorption Desorption

AbstractIn the present work, we have developed a mesoporous silicalite-1 using CMC as a template for the removal of MB from aqueous solution. The synthesized silicalite-1 were characterized using scanning electron microscopy (SEM), transmission electron microscopy (TEM), Fourier transform infrared spectroscopy (FT-IR), X-ray diffraction (XRD), thermogravimetric analysis (TGA), Energy-dispersive X-ray spectroscopy (EDAX) and N2 adsorption–desorption isotherm (BET). XRD and FT-IR analysis confirmed the formation of crystallinity and development of MFI structure in the mesoporous silicalite-1. The adsorption of MB dye on mesoporous silicalite-1 was conducted by batch adsorption method. The effect of various parameters such as adsorbent dosage, initial dye concentration, contact time and temperature on the dye uptake ability of silicalite-1 was investigated. The operating parameters for the maximum adsorption are silicalite-1 dosage (0.1 wt%), contact time (240 min), initial dye concentration (10 ppm) and temperature (30 ℃). The MB dye removal onto mesoporous silicalite-1 followed pseudo-second-order kinetic and Freundlich isotherm. The silicalite-1 exhibits 86% removal efficiency even after six adsorption–desorption cycle. Therefore, the developed mesoporous silicalite-1 is an effective eco-friendly adsorbent for MB dye removal from aqueous environment.

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Electrospun Nanosystems Based on PHBV and ZnO for Ecological Food Packaging

Polymers ◽

10.3390/polym13132123 ◽

2021 ◽

Vol 13 (13) ◽

pp. 2123

Author(s):

Maria Râpă ◽

Maria Stefan ◽

Paula Popa ◽

Dana Toloman ◽

Cristian Leostean ◽

...

Keyword(s):

Food Packaging ◽

Spin Trapping ◽

X Ray Diffraction ◽

Paramagnetic Resonance ◽

Hno3 Solution ◽

X Ray ◽

Trapping Method ◽

Ft Ir ◽

Doped Zno ◽

Electron Paramagnetic

The electrospun nanosystems containing poly(3-hydroxybutyrate-co-3-hydroxyvalerate) (PHBV) and 1 wt% Fe doped ZnO nanoparticles (NPs) (with the content of dopant in the range of 0–1 wt% Fe) deposited onto polylactic acid (PLA) film were prepared for food packaging application. They were investigated by scanning electron microscopy (SEM), energy dispersive X-ray (EDX), Fourier transform infrared spectroscopy (FT-IR), X-ray diffraction (XRD), antimicrobial analysis, and X-ray photoelectron spectrometry (XPS) techniques. Migration studies conducted in acetic acid 3% (wt/wt) and ethanol 10% (v/v) food simulants as well as by the use of treated ashes with 3% HNO3 solution reveal that the migration of Zn and Fe falls into the specific limits imposed by the legislation in force. Results indicated that the PLA/PHBV/ZnO:Fex electrospun nanosystems exhibit excellent antibacterial activity against the Pseudomonas aeruginosa (ATCC-27853) due to the generation of a larger amount of perhydroxyl (˙OOH) radicals as assessed using electron paramagnetic resonance (EPR) spectroscopy coupled with a spin trapping method.

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A study on using expanded perlite with hydroxyapatite: Reinforced bio-composites

Proceedings of the Institution of Mechanical Engineers Part H Journal of Engineering in Medicine ◽

10.1177/0954411921996565 ◽

2021 ◽

pp. 095441192199656

Author(s):

Erdoğan Karip ◽

Mehtap Muratoğlu

Keyword(s):

Body Fluid ◽

Xrd Analysis ◽

Cold Isostatic Pressing ◽

Expanded Perlite ◽

X Ray Diffraction ◽

Pressing Method ◽

X Ray ◽

Infra Red ◽

Ft Ir

People are exposed to different kinds of diseases or various accidents in life. Hydroxyapatite (HA) has been widely employed for bone treatment applications. In this study, HA was extracted from sheep bones. Bio-composites were doped with 1, 5, and 10 wt.% of expanded perlite and 5 wt.% of ZrO2–MgO-P2O5. The bio-composites were prepared by the cold isostatic pressing method (250 MPa) and sintered at 900°C for 1 h. In order to evaluate the characteristics of the bio-composites, microhardness, density, X-ray diffraction (XRD), Fourier transform infra-red spectroscopy (FT-IR), scanning electron microscopy (SEM), and energy dispersive spectroscopy (EDS) analyses were carried out on them. Additionally, the specimens whose characteristics were determined were kept in synthetic body fluid (SBF), and their in vitro behavior was examined. As a result, it was observed that microhardness increased as both the weight and the grain size of the expanded perlite were increased. Calcium silicate, tri-calcium phosphate, and hydroxyapatite were observed in the XRD analysis of all samples, and the formation of apatite structures was increased by addition of ZrO2–MgO–P2O5.

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Synthesis of Magnetic Ferrocene-Containing Polymer with Photothermal Effects for Rapid Degradation of Methylene Blue

Polymers ◽

10.3390/polym13040558 ◽

2021 ◽

Vol 13 (4) ◽

pp. 558

Author(s):

Wenhui Zhu ◽

Caiyun Zhang ◽

Yali Chen ◽

Qiliang Deng

Keyword(s):

Methylene Blue ◽

Photoelectron Spectroscopy ◽

Room Temperature ◽

Degradation Rate ◽

Model Compound ◽

Vibrating Sample Magnetometer ◽

Simulated Sunlight ◽

X Ray Diffraction ◽

X Ray ◽

Ft Ir

Photothermal materials are attracting more and more attention. In this research, we synthesized a ferrocene-containing polymer with magnetism and photothermal properties. The resulting polymer was characterized by Fourier-transform infrared (FT-IR), vibrating sample magnetometer (VSM), scanning electron microscope (SEM), energy dispersive X-ray spectroscopy (EDS), X-ray photoelectron spectroscopy (XPS), X-ray diffraction (XRD), and thermogravimetric analysis (TGA). Its photo-thermocatalytic activity was investigated by choosing methylene blue (MB) as a model compound. The degradation percent of MB under an irradiated 808 nm laser reaches 99.5% within 15 min, and the degradation rate is 0.5517 min−1, which is 145 times more than that of room temperature degradation. Under irradiation with simulated sunlight, the degradation rate is 0.0092 min−1, which is approximately 2.5 times more than that of room temperature degradation. The present study may open up a feasible route to degrade organic pollutants.

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Hydrothermal Synthesis, Characterization and Exploration of Photocatalytic Activities of Polyoxometalate: Ni-CoWO4 Nanoparticles

Crystals ◽

10.3390/cryst11050456 ◽

2021 ◽

Vol 11 (5) ◽

pp. 456

Author(s):

Fahad A. Alharthi ◽

Hamdah S. Alanazi ◽

Amjad Abdullah Alsyahi ◽

Naushad Ahmad

Keyword(s):

Electron Microscopy ◽

Hydrothermal Synthesis ◽

X Ray Diffraction ◽

X Ray ◽

Transmission Electron ◽

Structure Morphology ◽

Photocatalytic Activities ◽

Ft Ir ◽

Photocatalytic Reactions ◽

Cobalt Tungstate

This study demonstrated the hydrothermal synthesis of bimetallic nickel-cobalt tungstate nanostructures, Ni-CoWO4 (NCW-NPs), and their phase structure, morphology, porosity, and optical properties were examined using X-ray Diffraction (XRD), Fourier-transform infrared spectroscopy (FT-IR), Scanning electron microscopy- energy dispersive X-ray spectroscopy (SEM-EDS), high resolution Transmission electron microscopy (HR-TEM), Brunauer-Emmett-Teller (BET) and Raman instruments. It was found that as-calcined NCW-NPs have a monoclinic phase with crystal size ~50–60 nm and is mesoporous. It possessed smooth, spherical, and cubic shape microstructures with defined fringe distance (~0.342 nm). The photocatalytic degradation of methylene blue (MB) and rose bengal (RB) dye in the presence of NCW-NPs was evaluated, and about 49.85% of MB in 150 min and 92.28% of RB in 90 min degraded under visible light. In addition, based on the scavenger’s study, the mechanism for photocatalytic reactions is proposed.

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Multidimensional Ln-Aminophthalate Photoluminescent Coordination Polymers

Materials ◽

10.3390/ma14071786 ◽

2021 ◽

Vol 14 (7) ◽

pp. 1786

Author(s):

Carla Queirós ◽

Chen Sun ◽

Ana M. G. Silva ◽

Baltazar de Castro ◽

Juan Cabanillas-Gonzalez ◽

...

Keyword(s):

Water Content ◽

Coordination Polymers ◽

Metal Ion ◽

Low Cost ◽

Microwave Assisted Synthesis ◽

X Ray Diffraction ◽

X Ray ◽

Wide Range ◽

Ft Ir ◽

Ft Ir Spectroscopy

The development of straightforward reproducible methods for the preparation of new photoluminescent coordination polymers (CPs) is an important goal in luminescence and chemical sensing fields. Isophthalic acid derivatives have been reported for a wide range of applications, and in addition to their relatively low cost, have encouraged its use in the preparation of novel lanthanide-based coordination polymers (LnCPs). Considering that the photoluminescent properties of these CPs are highly dependent on the existence of water molecules in the crystal structure, our research efforts are now focused on the preparation of CP with the lowest water content possible, while considering a green chemistry approach. One- and two-dimensional (1D and 2D) LnCPs were prepared from 5-aminoisophthalic acid and Sm3+/Tb3+ using hydrothermal and/or microwave-assisted synthesis. The unprecedented LnCPs were characterized by single-crystal X-ray diffraction (SCRXD), powder X-ray diffraction (PXRD), Fourier transform infrared (FT-IR) spectroscopy and scanning electron microscopy (SEM), and their photoluminescence (PL) properties were studied in the solid state, at room temperature, using the CPs as powders and encapsulated in poly(methyl methacrylate (PMMA) films, envisaging the potential preparation of devices for sensing. The materials revealed interesting PL properties that depend on the dimensionality, metal ion, co-ligand used and water content.

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Incorporation of silver stearate nanoparticles in methacrylate polymeric monoliths for hemeprotein isolation

Open Chemistry ◽

10.1515/chem-2020-0051 ◽

2020 ◽

Vol 18 (1) ◽

pp. 399-411

Author(s):

Eman Alzahrani

Keyword(s):

Noble Metals ◽

Extraction Process ◽

Sem Analysis ◽

X Ray ◽

Polymeric Scaffold ◽

Extended Surface ◽

Unique Method ◽

Unique Approach ◽

Ft Ir ◽

Ft Ir Spectroscopy

AbstractA unique method was used to synthesize extremely stable silver stearate nanoparticles (AgStNPs) incorporated in an organic-based monolith. The facile strategy was then used to selectively isolate hemeproteins, myoglobin (Myo) and hemoglobin (Hb). Ethyl alcohol, silver nitrate, and stearic acid were, respectively, utilized as reducing agents, silver precursors, and capping agents. The color changed to cloudy from transparent, indicating that AgStNPs had been formed. AgStNP nanostructures were then distinctly integrated into the natural polymeric scaffold. To characterize the AgStNP–methacrylate polymeric monolith and the silver nanoparticles, energy-dispersive X-ray (EDX), scanning electron microscopy (SEM), and Fourier-transform infrared (FT-IR) spectroscopy were used. The results of the SEM analysis indicated that the AgStNP–methacrylate polymeric monolith’s texture was so rough in comparison with that of the methacrylate polymeric monolith, indicating that the extraction process of the monolith materials would be more efficient because of the extended surface area of the absorbent. The comparison between the FT-IR spectra of AgStNPs, the bare organic monolith, and AgStNP–methacrylate polymeric monolith confirms that the AgStNPs were immobilized on the surface of the organic monolith. The EDX profile of the built materials indicated an advanced peak of the Ag sequence which represented an Ag atom of 3.27%. The results therefore established that the AgStNPs had been successfully integrated into the monolithic materials. Extraction efficiencies of 92% and 97% were used to, respectively, recover preconcentrated Myo and Hb. An uncomplicated method is a unique approach of both fabrication and utilization of the nanosorbent to selectively isolate hemeproteins. The process can further be implemented by using other noble metals.

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