State of the art and research development prospects of energy and resource-efficient environmentally safe chemical process systems engineering

In this focus overview, the main types and directions of engineering, methods and techniques of intensification of chemical process systems (CPS) and process optimization of energy- and resource-efficient processes for the representative production of titanium compounds, mining waste processing systems, electrochemical coating technologies, combined technologies for the treatment of industrial effluents and energy-and resource-efficient technologies for cleaning soils from petroleum and chemical pollution products are reviewed. The following issues have been discussed: methods of complex assessment of production energy efficiency and software and information support for automated synthesis of optimal energy-efficient regenerative heat exchange systems using pinch analysis; methods and algorithms for fractal-statistical characteristics analysis of nonstationary gas flows in complex gas pipelines; methods of ecological and economic optimization of production, infrastructure supply chains; methods for assessing and preventing the dangerous environmental impact assessment of chemical pollution; organization and logistics management of business processes engineering for improving the energy efficiency of plants; engineering of problem oriented computer systems, heuristic-computational models and algorithms for intelligent integrated logistics support of the equipment life cycle; engineering developments in the field of digital transformation of energy-efficient CPS and technological production systems; application of methods for optimizing reliability factors optimization, digitalized risk and safety management in the engineering of energy- and resource efficient CPS.     

Main Features of the Synthesis and Formation of Cement-Containing Catalysts for Various Processes of Organic,Inorganic, and Environmental Catalysis

The formation of copper-, manganese-, nickel–copper, and other cement-containing catalysts for organic, inorganic, and environmental catalysis are studied by physicochemical and physicomechanical methods. The catalysts are prepared by chemical mixing, impregnation, and mechanochemical activation with high-pressure water jets (30–300 MPa). Strong metal–support interaction during the preparation of the catalysts and the introduction of manganese compounds stabilize copper ions in oxides, hampers the reduction of oxides, and improves the thermal stability of samples and the stability to mechanical disintegration during performance. Deeper interaction between copper and zinc salts enhances the efficiency of copper catalysts. The technologies of the industrial syntheses of catalysts for various industries is developed and used.     

Insight into the Sorption of 5-Fluorouracil and Methotrexate onto Soil–pH,Ionic Strength,and Co-Contaminant Influence

Nowadays anticancer drugs (ADs), like other pharmaceuticals, are recognized as new emerging pollutants, meaning that they are not commonly monitored in the environment; however, they have great potential to enter the environment and cause adverse effects there. The current scientific literature highlights the problem of their presence in the aquatic environment by publishing more and more results on their analytics and ecotoxicological evaluation. In order to properly assess the risk associated with the presence of ADs in the environment, it is also necessary to investigate the processes that are important in understanding the environmental fate of these compounds. However, the state of knowledge on mobility of ADs in the environment is still very limited. Therefore, the main aim of our study was to investigate the sorption potential of two anticancer drugs, 5-fluorouracil (5-FU) and methotrexate (MTX), onto different soils. Special attention was paid to the determination of the influence of pH and ionic strength as well as presence of co-contaminants (cadmium (Cd²⁺) and another pharmaceutical—metoprolol (MET)) on the sorption of 5-FU and MTX onto soil. The obtained distribution coefficient values (K_d) ranged from 2.52 to 6.36 L·kg⁻¹ and from 6.79 to 12.94 L·kg⁻¹ for 5-FU and MTX, respectively. Investigated compounds may be classified as slightly or low mobile in the soil matrix (depending on soil). 5-FU may be recognized as more mobile in comparison to MET. It was proved that presence of other soil contaminants may strongly influence their mobility in soil structures. The investigated co-contaminant (MET) caused around 25-fold increased sorption of 5-FU, whereas diminished sorption of MTX. Moreover, the influence of environmental conditions such as pH and ionic strength on their sorption has been clearly demonstrated.     

Monitoring nanoparticles in the environment

The presence of nanoparticles in the environment can have important implications for both environmental and human health. Nanoscience and nanotechnology are expected to change industrial production and the economy as we know them today. However, nanotechnologies can also be a source of risks. The increasing use of nanoparticles in industrial applications will inevitably lead to the release of such materials into the environment. Accurately assessing the environmental risks posed by nanoparticles requires using effective quantitative analytical methods to determine their mobility, reactivity, ecotoxicity and persistency, many of which have still to be developed. This overview describes some methodological aspects relating to the fields of nanoparticle analysis, nanometrology and analytical chemistry.     

Investigation on Distribution and Risk Assessment of Volatile Organic Compounds in Surface Water,Sediment, and Soil in a Chemical Industrial Park and Adjacent Area

The occurrences, distributions, and risks of 55 target volatile organic compounds (VOCs) in water, sediment, sludge, and soil samples taken from a chemical industrial park and the adjacent area were investigated in this study. The Σ₅₅-VOCs concentrations in the water, sediment, sludge, and soil samples were 1.22–5449.21 μg L⁻¹, ND–52.20 ng g⁻¹, 21.53 ng g⁻¹, and ND–11.58 ng g⁻¹, respectively. The main products in this park are medicines, pesticides, and novel materials. As for the species of VOCs, aromatic hydrocarbons were the dominant VOCs in the soil samples, whereas halogenated aliphatic hydrocarbons were the dominant VOCs in the water samples. The VOCs concentrations in water samples collected at different locations varied by 1–3 orders of magnitude, and the average concentration in river water inside the park was obviously higher than that in river water outside the park. However, the risk quotients for most of the VOCs indicated a low risk to the relevant, sensitive aquatic organisms in the river water. The average VOCs concentration in soil from the park was slightly higher than that from the adjacent area. This result showed that the chemical industrial park had a limited impact on the surrounding soil, while the use of pesticides, incomplete combustion of coal and biomass, and automobile exhaust emissions are all potential sources of the VOCs in the environmental soil. The results of this study could be used to evaluate the effects of VOCs emitted from chemical production and transportation in the park on the surrounding environment.     

Determination of methylmercury fluxes across the air–water and air–soil interfaces by gas chromatography with electron capture detection

A method for the determination of methylmercury (MeHg) fluxes across the air–water and air–soil interfaces was developed using an in situ chamber. The MeHg in the air coming out of the chamber was captured by a column containing sulfhydryl cotton fiber adsorbent. MeHg was then desorbed from the column by using 2 mol L^–1 HCl. The MeHg in the effluent was extracted with benzene, and determined by gas chromatography with electron capture detection. Finally, the MeHg flux was calculated using the chamber. The method was applied to simulated experiments, and the results showed that the MeHg fluxes in the air–water system were higher than those in the air–soil–water system. The method was also successfully applied to the field measurements of an environment polluted by a chemical factory, and the results showed that the MeHg fluxes across the air–soil and air–water interfaces were 0.21–3.09 and 0.14–0.79 ng m^–2 h^–1, respectively. The method will be a useful tool in the environmental study of MeHg.     

The Future of Flame Retardant Polymers – Unmet Needs and Likely New Approaches

ABSTRACT

Thermoplastic and thermoset polymers in use today have fire risk and fire hazard associated with them that is not always well known to the public or material scientists. Recent events in the United Kingdom and California show that, if not considered carefully, use of flammable materials can result in catastrophic losses of both life and property. Further, current understanding has shown that simply adding flame retardant chemicals to polymers to address fire hazard and risk is not sufficient, as there is an increased demand from consumers, government, and industry for improved durability, recyclability, fire safety, and reduced environmental impact. These new requirements are beginning to change flame retardant chemistry for polymers, which has been mostly unchanged for the past 50 years. Existing flame retardant chemical technology will be briefly reviewed to show what is available today, followed by a discussion of potential future flame retardant approaches. Future possibilities such as polymeric, reactive, inorganic, and transition metal chemistries will be surveyed and discussed, with emphasis on what is not fully understood or validated for commercial use or future research and development investment. Current unmet fire safety needs of polymers, based upon current information and technological trends, will also be discussed.     

Environmental Implications of Heavy Metals in Soil from Huainan,China

Soil metal contamination is of great concern due to these elements’ bioavailability, toxicity, and persistence. A total of forty soil samples were collected from mining, industrial, agricultural, and residential areas. Inductively coupled plasma–mass spectrometry (ICP–MS) was employed to determine the concentrations of the heavy metals (As, Cd, Cr, Cu, Pb, and Zn). Geoaccumulation indices and health risk assessment models were employed to evaluate the potential ecological and health implications. The concentrations of As, Cr, and Zn in the industrial zone were higher than the values from the other areas, whereas the concentrations of Cd, Cu, and Pb were highest in the residential area. The distribution of metals may be attributed to different anthropogenic sources. The soils in the industrial area were moderately contaminated by As. The noncarcinogenic risk due to metals was determined to be negligible in these areas, while a high carcinogenic risk was obtained in the industrial area. The priority controls should be As, Cd, and Cr in the industrial area. However, the ecological, environmental, and health implications in the mining and residential areas should also be monitored. This study provides a comprehensive investigation of soil metals in industrial, mining, residential, and agricultural areas in China that may be employed for future environmental management and regularization.     

Study of the lipophilicity of selenium species

In this work the lipophilicity of different selenium species occurring in environmental matrices and food, Se(IV), Se(VI), selenomethionine (Se-Met), selenocystamine (Se-CM), selenocystine (Se-Cyst), and dimethyl diselenide (CH₃)₂Se₂, was investigated in the octanol–water system, using the shaking flask method and detection with inductively coupled plasma–atomic emission spectrometry (ICP–AES), in order to assess their environmental fate and tendency to bioaccumulate. Polarography was also used for the electrochemically active Se species, Se(IV), Se-Cyst, Se-CM and (CH₃)₂Se₂, and the results were compared with those measured by ICP–AES. Furthermore, the influence of pH was studied by determining the logarithm of the distribution coefficient, log D, at three pH values, 5, 7, and 9, as was the impact of the marine environment on the lipophilicity profile of the six investigated Se species. The results were compared with those estimated approximately by use of PrologD software, based on the Ghose-Crippen log P (P: partition coefficient) calculation system, the only system which incorporates values—even though approximate—for the atom type of Se. Finally, from our experimental data an indicative value of the Se–Se fragment for log P prediction, for use in drug design, was estimated.     

Inherent safety evaluation in process plants— a comparison of methodologies

A global population increase and an improved standard of living are generally expected. To meet these demands, an increased production of chemicals will be necessary while protecting human health and the environment. However, most current methods of chemical production are unsustainable. New designs must result in plants that assure process and operator safety, the sustained health of workers and the community, and the protection of the environment. Traditional safety precautions and process controls minimize risk but cannot guarantee the prevention of accidents followed by serious consequences. Therefore, the general approach to environmental and safety problems must be changed from reactive to proactive. One way is to further develop the concept of inherent safety. In this paper some methods for inherent safety evaluations are reviewed. The aim of the study is to analyze the different tools available for inherent safety evaluation and identify the most important criteria in determining the inherent safety of a process plant. A model is proposed to show the interactions of different factors on the inherent safety level of a process and the model is illustrated by a case study.     

Groundwater Quality at the Huaibei Coalfield,China

The environmental and health impacts of trace elements are of great concern because of their toxicity, persistence, and bioavailability. Twenty-six groundwater samples were collected from the coal mining areas to evaluate water quality and potential environmental impact caused by mining activities. The physical/chemical properties and trace element concentrations (As, Cd, Cr, Cu, Pb, and Zn) were determined. The physical/chemical parameters and the concentrations of trace elements varied among the shallow and confined groundwater, which may indicate the absence of hydraulic interactions between the aquifers. The concentrations of trace elements in the mining areas are higher than at background monitoring sites, which suggests that the mining activities may lead to environmental and health impacts. Based on a health risk assessment, the low hazard quotients and cancer risk values in confined groundwater samples indicate that the chronic and cancer adverse effects due to trace elements are negligible. This study provides a comprehensive assessment of groundwater trace element impacts from coal mining in China and is useful for environmental management.     

Effect of the composition of binary polar solvent mixtures on dye adsorptivity in the polymer matrix

Sorption and diffusion processes of 1-mercapto-2-naphthol nickel complex in a polymer matrix upon surface dyeing of polymethyl methacrylate are studied by near-IR spectroscopy as a function of dye solution composition and technological parameters of the process. The optimum solution composition and technological regime are selected. The diffusion coefficient is evaluated.Translated fromIzvestiya Akademii Nauk. Seriya Khimicheskaya, No. 7, pp. 1289–1293, July, 1995.The authors express their gratitude to Dr. Chem. Sci. N. O. Mchedlov-Petrosyan for a series of valuable remarks in his discussion of this work.This work was carried out with financial support from the International Science Foundation (Grant U2V000).     

Convective and Diffusion Processes in a Multicomponent Electrochemical Water Purification System

An electrochemical system (ES), which is a multicomponent working environment where bulk chemical reactions occur, is considered. Non-steady-state fields of concentrations, electric potential, velocities, and temperature are modeled mathematically. Dissipative structure of ES as a whole and in local regions is quantitatively estimated in a Prigogine–Glansdorff stability study. The calculation results may come useful in controlling technological parameters of ES intended for water purification.     

Electrochemical synthesis of metal alkoxides. Prospects of commercial alkoxides production

A production method of Ti, Zr, Nb, Ta, Y, Sn, Cu, Ge, Mo, W and some other metals alkoxides at their anode polarization in alcohols (methanol, ethanol, i-propanol, butanol, methoxy-ethanol) in the presence of an electroconductive additive has been developed.As a result of theoretical and experimental studies and engineering development, a universal low-waste technological processes of the electrochemical production of the above high purity alkoxides have been established.Metal efficiency coefficient in the electrosynthesis process is 0.85–0.90, current efficiency is 75–80%, and specific power consumption is within 5–10 kW-h/kg range.The total of impurities provided by this technology does not exceed 10^–3% mass.The developed electrochemical technology has been realized at a pilot-commercial scale at AO NIPIM plant (Russia, Tula) in order to manufacture a high purity titanium tetrabutoxide at 1.5–2.0 t/year plant operation the actual advantages of the electrochemical technology comparing to a traditional chemical one have been revealed.A considerable simplification of the developed electrochemical technology has been achieved at the anode polarization of metals in the methxyethanol due to elimination from the diagram scope of units for the alkoxides separation from after electrolysis solutions and recovery of unreacted raw components.     

Determination of 5-fluorouracil in hospital effluents

Cytostatic anticancer drugs are an increasingly important issue in the environmental debate, mainly due to the lack of knowledge about the fate of these toxic substances. Over the last decades, 5-fluorouracil (5-FU) has been one of the most frequently used antineoplastic agents and may, therefore, be regarded as one of the pilot substances for environmental contamination. As a prerequisite for these investigations, a method for the determination of 5-FU in hospital effluents has been developed. Waste water samples were enriched by solid-phase extraction on ENV⁺ columns (concentration factor 500) and analysed by capillary electrophoresis using a buffer containing 80% 160 mM sodium borate buffer (pH 9.5) and 20% acetonitrile (v/v). This method is applicable within the range 5–500 g 5-FU L^–1. The standard curve (correlation coefficient >0.99) was linear with recovery rates from 80 to 96% and an accuracy from 9.0 to 20% (intra-assay standard deviation 0.7–8.9%; inter-assay standard deviation 2.2–9.5%). Based on the consumption of 5-FU in oncologic departments and the detection limit of 1.7 g L^–1, this method covers the range necessary to evaluate 5-FU in hospital effluents. The applicability of the method was proven by chemical analysis of real hospital waste water samples. Obtained over a time period of 1 month (range 20–122 g 5-FU L^–1), the results were similar to those calculated by an input–output model. The presented method provides an analytical tool necessary to face the monitoring of environmental contamination problems.Abbreviations 5-FU 5-Fluorouracil - OECD Organization for economic cooperation and development     

云南东川区域重金属环境暴露健康风险评价

以云南省昆明市东川主要河流及附近土壤、植物为研究对象,对其进行采样分析,并根据美国环境保护署(U.S.EPA)推荐健康风险评价方法对东川流域多种环境因素进行了重金属的健康风险评价。结果表明,水环境中致癌物质造成的风险最大,风险值在2.35×10^(-4)~8.27×10^(-4),达到U.S.EPA推荐的最大值10^(-4),植物根部的健康风险值为0.40×10^(-1)~7.00×10^(-1),茎叶部分的风险值为2.42×10^(-2)~15.24×10^(-2),根部存在的重金属对人体的健康风险约为茎叶部分的5倍;土壤中非致癌物质的健康风险影响较大,总健康风险值区间为0.64×10^(-1)~3.83×10^(-1)。评价结果可为该区域地表水、土壤和植物资源的污染治理、保护开发提供依据。     

Chemistry and Dual Use: From Scientific Integrity to Social Responsibility

Ethical aspects of chemical activity are often exclusively located in the field of scientific integrity and good scientific practice. Yet, there is another dimension of ethics in chemistry that is not covered by research ethics: the impact of chemical scientific and technological progress on society and environment. Here, especially, the dual character of manifestations of chemical progress (new compounds, materials, and processes) is discussed. This essay aims at clarifying the roles, responsibilities, and chances of chemists to contribute to the assessment and management of dual use risks. Its main argument is that the framework for an efficient risk assessment has been established in science and technology governance, based on the sustainability concept. Without having to worry about exceeding their core competences too much – as in ‘Ethics is not my business!’ – chemists’ expertise and knowledge plays a crucial role in tackling the most urging issues of our times as part of a larger interdisciplinary endeavour.     

化学品数据信息搜索引擎ChemDB Portal

化学品的性质、用途、安全使用等相关的知识是专业人员、特别是工业界的从业人员最大程度地降低健康和环境风险,合理地合成新化学品以及利用已有化学品的基础,也是公众消除对化学的误解、客观认识化学品在日常生活中功用和使用限度的前提。利用网络化、可公开访问的化学数据库资源获取化学品数据信息日益成为首选的途径,但目前对这些数据库的检...     

Filtration in Nonuniform Capillary–Porous Media: Equations of the Statistical Theory

Relationships between the statistical distribution of the filtration coefficient in a nonuniform capillary–porous medium and its total value for a filter layer are obtained. A closed set of equations where higher-order correlation moments of statistical fields serve as transferable entities is derived. The approach developed in this study makes it possible to study detailed laws of filtration in a nonuniform capillary–porous medium using the data on the filtration coefficient statistics, which is determined by the structure of the porous space.     

Composition of the waxes from the production wastes of lavender and sage oils

The chemical compositions of the waxes and the wastes from the production of lavender and sage oils and also the influence of industrial treatment with hydrogen peroxide on their composition have been established.Institute of the Chemistry of Plant Substances, Academy of Sciences of the Uzbek SSR, Tashkent. Translated from Khimiya Prirodnykh Soedinenii, No. 6, pp. 707–712, November–December, 1984.