scholarly journals Process safety assessment of semibatch nitration of naphthalene with mixed acid to 1-nitronaphthalene

2021 ◽  
Author(s):  
Jun Liang ◽  
Lei Ni ◽  
Peihong Wu ◽  
Hang Yao ◽  
Qiang Chen ◽  
...  
Keyword(s):  
High Performance ◽  
Safety Assessment ◽  
Function Theory ◽  
Analytical Techniques ◽  
Density Function Theory ◽  
Reaction Calorimetry ◽  
Process Safety ◽  
Scanning Calorimetry ◽  
Kinetics Parameters ◽  
Mixed Acid

In this study, different calorimetric and analytical techniques were used to evaluate the thermal behaviour of the preparation of 1-nitronaphthalene through the nitration of naphthalene with mixed acid. Differential scanning calorimetry and adiabatic calorimetry revealed that 1-nitronaphthalene lacks thermal decomposition characteristics. The results of reaction calorimetry, high-performance liquid chromatography, and the density function theory method were combined to analyse the reaction mechanism. An expanded Stoessel criticality diagram was developed to evaluate the process safety of the semibatch nitration reaction. The results revealed a higher degree of risk than that obtained when using the traditional Stoessel criticality diagram. Kinetics parameters of the reaction were investigated.

Thermal behaviour of benzoxazine blends based on epoxy and cyanate ester

2021 ◽  
Vol 29 (9_suppl) ◽  
pp. S1475-S1485
Author(s):  
Balaji Krishnasamy ◽  
Hariharan Arumugam ◽  
Mohamed Iqbal M ◽  
Alagar Muthukaruppan
Keyword(s):  
High Performance ◽  
Analytical Techniques ◽  
Cyanate Ester ◽  
Resonance Spectroscopy ◽  
Scanning Calorimetry ◽  
Limiting Oxygen Index ◽  
Polymeric Matrices ◽  
Bisphenol F ◽  
Degradation Temperature ◽  
Cure Behaviour

In the present work, an attempt has been made to develop high-performance polymeric hybrid binary blends of epoxy/benzoxazine and benzoxazine/cyanate ester with varying weight percentages (25/75, 50/50 and 75/25 wt%) of resins, namely, bisphenol-F epoxy resin (DGEBF), benzoxazines [bisphenol–F/aniline (BF-a) and imidazole core-based bisphenol/aniline (IBP-a)] and cyanate ester [bisphenol-F bifunctional cyanate ester (BF-CE)]. The molecular structure, polymerisation temperature/cure behaviour, glass transition temperature (Tg) and thermal stability of the neat polymeric matrices and binary hybrid blends of polymeric matrices were characterised using different analytical techniques, viz. Fourier Transform infra-red spectroscopy (FTIR), Nuclear Magnetic Resonance spectroscopy (NMR), Differential Scanning Calorimetry (DSC) and thermogravimetric analysis (TGA). Among the binary hybrid blends, the lowest polymerisation temperatures (Tp) were noticed in the case of blends of epoxy/benzoxazine were 219°C for DGEBF/BF-a (25/75 wt%) and 170°C for DGEBF/IBP-a (25/75 wt%). Similarly, in the case of blends of benzoxazine/cyanate ester, the lowest values of Tp observed were 155°C and 153°C for BF-a/BF-CE (75/25 wt%) and IBP-a/BF-CE (75/25 wt%), respectively. The highest values of Tg observed for the blends of epoxy/benzoxazine were 175°C and 254°C for DGEBF/BF-a (25/75 wt%) and DGEBF/IBP-a (25/75 wt%), respectively. Whereas, the highest values of Tg observed in the case of blends of benzoxazine/cyanate ester were 234°C and 278°C for BF-a/BF-CE (25/75 wt%) and IBP-a/BF-CE (75/25 wt%), respectively. From the TGA results of blends, the maximum degradation temperature (Tmax) and limiting oxygen index (LOI) value calculated from the char yield, which ascertain that almost all the binary hybrid blends of epoxy/benzoxazine and benzoxazine/cyanate ester possess good flame retardant behaviour.

Lacidipine: review of analytical methods developed for pharmaceutical dosage forms and biological fluids

Bioanalysis ◽  
2021 ◽  
Author(s):  
Sai Tejasvini Chebrolu ◽  
Lalit Kumar ◽  
Ruchi Verma
Keyword(s):  
High Performance ◽  
Limit Of Detection ◽  
Biological Fluids ◽  
Ultra Violet ◽  
Analytical Techniques ◽  
Dosage Forms ◽  
X Ray Diffraction ◽  
Scanning Calorimetry ◽  
Limit Of Quantification ◽  
Pharmaceutical Dosage Forms

Lacidipine (LAC) is a calcium antagonist used in the treatment of hypertension. It is a lipophilic drug containing dihydropyridine ring that is responsible for the activity. This review article gives an overview of various analytical techniques proposed for the determination of LAC in pharmaceutical dosage forms, in pure form, in biological fluids and to determine characteristics of LAC in modified release dosage forms. Ultra violet/visible spectrophotometric, spectroflourimetric, high performance liquid chromatography, high performance thin layer chromatography, electro-analytical, bioanalytical and miscellaneous methods such as microbiological assay, X-ray diffraction, differential scanning calorimetry, were discussed. Various parameters such as system suitability, selectivity, linearity, precision, accuracy, limit of detection, limit of quantification and robustness have been discussed for the employed methods.

Sustainable Reactive Dyeing of Cotton Fabric in Green Non-Aqueous Medium: A Density Function Theory (DFT) Modeling Study

2015 ◽  
Vol 671 ◽  
pp. 139-148 ◽  
Author(s):  
Lu Yi Chen ◽  
Jian Gang Chen ◽  
Xin Hui Ruan ◽  
Su Xin Xu ◽  
Yi Qi Yang ◽  
...  
Keyword(s):  
Dft Calculations ◽  
Density Function ◽  
High Performance ◽  
Function Theory ◽  
Dye Adsorption ◽  
Density Function Theory ◽  
Green Solvents ◽  
Reactive Dyeing ◽  
Organic Bases ◽  
Reactive Orange

Sustainable reactive dyeing of cotton in green non-nucleophilic solvents was investigated. Dye fixation in the new medium was modeled using DFT calculations with the aim of understanding the role of organic bases. The novel procedure uses non-nucleophilic green solvents instead of water to eliminate the dye hydrolysis. All residuals in the spent dye bath could be conveniently recycled and reused. The three major stages in cotton reactive dyeing, cellulose swelling, dye adsorption and dye fixation were optimized respectively. Two organic bases and potassium carbonate were studied for dye fixation. The mechanisms of the amine-promoted dye fixation were modeled using density function theory (DFT) calculations. The formation of the amine-dye intermediate was elucidated and analyzed using high performance liquid chromatography (HPLC) analysis. The quaternary ammonium catalysis effect on intermediates forming was observed. A 10-cycle repeated dyeing sequence was demonstrated using Reactive orange 5 to give consistently high shade buildup, excellent colorfastness and dramatic reduction in resource consumption. The results have implications for better understanding the new hydrolysis-free and recyclable solvent dyeing process.

Phytoceuticals in aniseeds: a practical approach for isolation and identification

2016 ◽  
Vol 5 (01) ◽  
pp. 4701
Author(s):  
Shobha R. I. ◽  
Andallu B.
Keyword(s):  
Chronic Diseases ◽  
Column Chromatography ◽  
High Performance ◽  
Methanolic Extract ◽  
Analytical Techniques ◽  
Therapeutic Agents ◽  
Systematic Research ◽  
Isolation And Identification ◽  
Traditional System ◽  
Pharmacologically Active

Nature has provided mankind with a broad and structurally diverse array of pharmacologically active chemical compounds, phytoceuticals, which have proved to be indispensable for the cure of chronic diseases or as lead structures for novel therapeutic agents. Almost, 70% of modern medicines in India have been developed from plants used in the traditional system of medicine. With the technological advances and the development of more sophisticated isolation and analytical techniques, there is great scope for further systematic research to screen and isolate many more phytoceuticals which might be more effective/as effective as synthetic drugs and thereby assess their potential in protecting against chronic diseases. The present investigation is aimed at isolation and identification of phytoceuticals in a spice, aniseed (Pimpinella anisum L), therapeutically less-exploited and widely used only for culinary purpose, using analytical techniques viz. column chromatography, high performance thin layer chromatography (HPTLC.) and nuclear magnetic resonance spectrometry. Among all the solvent fractions of methanolic extract tested, methanolic extract and ethyl acetate fraction possessed highest amounts of bioactive compounds viz. phenolics, flavonoids, flavonols which was confirmed by qualitative, quantitative and HPTLC. analyses. Spectral analysis using NMR. of one of the sub-fractions of aniseeds obtained by column chromatography, revealed the presence of a glycosylated flavone, luteolin-6C-glucoside in aniseeds.  The present study revealed aniseeds to be a great source of bioactive phytoceuticals which can be novel candidates for development of new therapeutic agents.

Star-shaped arylacetylene resins derived from silicon

2020 ◽  
Vol 40 (8) ◽  
pp. 676-684
Author(s):  
Niping Dai ◽  
Junkun Tang ◽  
Manping Ma ◽  
Xiaotian Liu ◽  
Chuan Li ◽  
...  
Keyword(s):  
High Performance ◽  
Room Temperature ◽  
Mechanical Test ◽  
Flexural Modulus ◽  
Mechanical Analysis ◽  
Reinforced Composites ◽  
Scanning Calorimetry ◽  
Chemical Structures ◽  
Structures And Properties ◽  
High Performance Resin

AbstractStar-shaped arylacetylene resins, tris(3-ethynyl-phenylethynyl)methylsilane, tris(3-ethynyl-phenylethynyl) phenylsilane, and tris (3-ethynyl-phenylethynyl) silane (TEPHS), were synthesized through Grignard reaction between 1,3-diethynylbenzene and three types of trichlorinated silanes. The chemical structures and properties of the resins were characterized by means of nuclear magnetic resonance, fourier-transform infrared spectroscopy, Haake torque rheomoter, differential scanning calorimetry, dynamic mechanical analysis, mechanical test, and thermogravimetric analysis. The results show that the melt viscosity at 120 °C is lower than 150 mPa⋅s, and the processing windows are as wide as 60 °C for the resins. The resins cure at the temperature as low as 150 °C. The good processabilities make the resins to be suitable for resin transfer molding. The cured resins exhibit high flexural modulus and excellent heat-resistance. The flexural modulus of the cured TEPHS at room temperature arrives at as high as 10.9 GPa. Its temperature of 5% weight loss (Td5) is up to 697 °C in nitrogen. The resins show the potential for application in fiber-reinforced composites as high-performance resin in the field of aviation and aerospace.

scholarly journals Effect of Nanofiller Content on Dynamic Mechanical and Thermal Properties of Multi-Walled Carbon Nanotube and Montmorillonite Nanoclay Filler Hybrid Shape Memory Epoxy Composites

Polymers ◽  
2021 ◽  
Vol 13 (5) ◽  
pp. 700
Author(s):  
Muhamad Hasfanizam Mat Yazik ◽  
Mohamed Thariq Hameed Sultan ◽  
Mohammad Jawaid ◽  
Abd Rahim Abu Talib ◽  
Norkhairunnisa Mazlan ◽  
...  
Keyword(s):  
Shape Memory ◽  
High Performance ◽  
Loss Modulus ◽  
Decomposition Temperature ◽  
Hybrid Nanocomposites ◽  
Mechanical And Thermal Properties ◽  
Scanning Calorimetry ◽  
Hybrid Filler ◽  
Dynamic Mechanical ◽  
Tan Δ

The aim of the present study has been to evaluate the effect of hybridization of montmorillonite (MMT) and multi-walled carbon nanotubes (MWCNT) on the thermal and viscoelastic properties of shape memory epoxy polymer (SMEP) nanocomposites. In this study, ultra-sonication was utilized to disperse 1%, 3%, and 5% MMT in combination with 0.5%, 1%, and 1.5% MWCNT into the epoxy system. The fabricated SMEP hybrid nanocomposites were characterized via differential scanning calorimetry, dynamic mechanical analysis, and thermogravimetric analysis. The storage modulus (E’), loss modulus (E”), tan δ, decomposition temperature, and decomposition rate, varied upon the addition of the fillers. Tan δ indicated a reduction of glass transition temperature (Tg) for all the hybrid SMEP nanocomposites. 3% MMT/1% MWCNT displayed best overall performance compared to other hybrid filler concentrations and indicated a better mechanical property compared to neat SMEP. These findings open a way to develop novel high-performance composites for various potential applications, such as morphing structures and actuators, as well as biomedical devices.

scholarly journals Determination of amino acids in human biological fluids by high-performance liquid chromatography: critical review

Amino Acids ◽  
2021 ◽  
Author(s):  
Grażyna Gałęzowska ◽  
Joanna Ratajczyk ◽  
Lidia Wolska
Keyword(s):  
Amino Acids ◽  
Amino Acid ◽  
High Performance ◽  
Hplc Analysis ◽  
Limit Of Detection ◽  
Biological Fluids ◽  
Analytical Techniques ◽  
Epidemiological Studies ◽  
Preparation Conditions

AbstractThe quantitation and qualification of amino acids are most commonly used in clinical and epidemiological studies, and provide an excellent way of monitoring compounds in human fluids which have not been monitored previously, to prevent some diseases. Because of this, it is not surprising that scientific interest in evaluating these compounds has resurfaced in recent years and has precipitated the development of a multitude of new analytical techniques. This review considers recent developments in HPLC analytics on the basis of publications from the last few years. It helps to update and systematize knowledge in this area. Particular attention is paid to the progress of analytical methods, pointing out the advantages and drawbacks of the various techniques used for the preparation, separation and determination of amino acids. Depending on the type of sample, the preparation conditions for HPLC analysis change. For this reason, the review has focused on three types of samples, namely urine, blood and cerebrospinal fluid. Despite time-consuming sample preparation before HPLC analysis, an additional derivatization technique should be used, depending on the detection technique used. There are proposals for columns that are specially modified for amino acid separation without derivatization, but the limit of detection of the substance is less beneficial. In view of the fact that amino acid analyses have been performed for years and new solutions may generate increased costs, it may turn out that older proposals are much more advantageous.

Thermal properties of polybenzoxazine exhibiting improved toughness: Blending with cyclodextrin and its derivatives

2021 ◽  
pp. 095400832110130
Author(s):  
Hailong Li ◽  
Sipei Zhao ◽  
Li Pei ◽  
Zihe Qiao ◽  
Ding Han ◽  
...  
Keyword(s):  
Thermal Properties ◽  
Hydrogen Bonds ◽  
High Performance ◽  
Practical Application ◽  
Scanning Calorimetry ◽  
Thermoset Resins ◽  
Chemical Structures ◽  
Microscopy Techniques ◽  
Fractured Surface ◽  
Scanning Electron

Polybenzoxazines are emerging as a class of high-performance thermoset polymers that can find their applications in various fields. However, its practical application is limited by its low toughness. The cyclic β-cyclodextrin and a newly synthesized derivative (β-cyclodextrin-MAH) were separately blended with benzoxazine to improve the toughness of polybenzoxazine. The results revealed that the maximum impact strength of the blend was 12.24 kJ·m−2 and 14.29 kJ·m−2 when 1 wt.% of β-Cyclodextrin and β-Cyclodextrin-MAH, respectively, were used. The strengths were 53% and 86% higher than that of pure polybenzoxazine. The curing reaction, possible chemical structures, and fractured surface were examined using differential scanning calorimetry, Fourier transform infrared spectroscopy, and scanning electron microscopy techniques to understand the mechanism of generation of toughness. The results revealed that the sea-island structure and the presence of hydrogen bonds between polybenzoxazine and β-cyclodextrin and β-cyclodextrin-MAH resulted in the generation of toughness. Furthermore, the curves generated during thermogravimetric analysis did not significantly change, revealing the good thermal properties of the system. The phase-separated structure and the hydrogen bonds present in the system can be exploited to prepare synergistically tough polybenzoxazine exhibiting excellent thermal properties. This can be a potential way of modifying the thermoset resins.

scholarly journals Selective hydrogenation of 5-(hydroxymethyl)furfural to 5-methylfurfural over single atomic metals anchored on Nb2O5

2021 ◽  
Vol 12 (1) ◽  
Author(s):  
Shaopeng Li ◽  
Minghua Dong ◽  
Junjuan Yang ◽  
Xiaomeng Cheng ◽  
Xiaojun Shen ◽  
...  
Keyword(s):  
Selective Hydrogenation ◽  
Function Theory ◽  
Density Function Theory ◽  
Reducing Agent ◽  
Dft Studies ◽  
Complete Conversion ◽  
Hydroxymethyl Furfural ◽  
Metal Atoms ◽  
Direct Hydrogenation ◽  
Reaction Result

Abstract5-Methylfurfural (MF) is a very useful chemical. Selective hydrogenation of biomass platform molecule 5-(hydroxymethyl)furfural (HMF) to MF using H2 as the reducing agent is very attractive, but challenging because hydrogenation of C=O bond in HMF is more favourable than C–OH both kinetically and thermodynamically, and this route has not been realized. In this work, we prepare isolated single atomic catalysts (SACs) Pt1/Nb2O5-Ov, Pd1/Nb2O5-Ov, and Au1/Nb2O5-Ov, in which single metal atoms are supported on oxygen defective Nb2O5 (Nb2O5-Ov). It is discovered that the SACs can efficiently catalyze the hydrogenation of HMF to MF using H2 as the reducing agent with MF selectivity of >99% at complete conversion, while the selectivities of the metal nanocatalysts supported on Nb2O5 are very poor. A combination of experimental and density function theory (DFT) studies show that the unique features of the SACs for the reaction result from the cooperation of the Nb and Pt sites near the interface in the Pt1/Nb2O5-Ov. The Pt atoms are responsible for the activation of H2 and the Nb sites activate C-OH in the reaction. This work opens the way for producing MF by direct hydrogenation of biomass-derived HMF using H2 as the reductant.

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