Evaluating the population pharmacokinetic parameters, biological half-life (HL), and apparent volume of distribution (Vd) is important for identifying potential risks of chemicals. In this study, we developed a framework of stacking machine learning models for predicting the two parameters, providing more generalized prediction methods for data from diverse sources. We built a larger database containing experimental data for 2934 and 1787 substances for HL and Vd, respectively, and considered two different chemical featurization methods. We employed five individual algorithms (Support Vector Regression, Random Forest, Gaussian Process, Artificial Neural Network, and Extreme Gradient Boosting) to construct the base models, and then combined predictions using Multiple Linear Regression to obtain 4 stacking models. Our stacking models performed well and outperformed the corresponding base models, with the extended connectivity fingerprint-based stacking model achieving the best predictive performance. The accuracy of the models, as defined by the applicability domain, was further improved, retaining more than 60% of the test data. Finally, we developed a publicly accessible online Web site (http://tkpara.hhra.net), where users can easily and quickly utilize our models. Our work provides data support for human health risk assessment of chemicals and for the use and management of chemicals or industrial products.
{"title":"Using Stacking Ensemble Machine Learning to Estimate the Human Half-Life and Apparent Volume of Distribution: Implications for Human Health Risk Assessment","authors":"Bixuan Wang, , , Yuzhe Li, , , Jie Zheng, , , Wenhong Fan, , , Ying Wang, , , Fujun Ma, , , Min Chen*, , and , Zhaomin Dong*, ","doi":"10.1021/acs.chas.5c00166","DOIUrl":"https://doi.org/10.1021/acs.chas.5c00166","url":null,"abstract":"<p >Evaluating the population pharmacokinetic parameters, biological half-life (HL), and apparent volume of distribution (<i>V</i><sub>d</sub>) is important for identifying potential risks of chemicals. In this study, we developed a framework of stacking machine learning models for predicting the two parameters, providing more generalized prediction methods for data from diverse sources. We built a larger database containing experimental data for 2934 and 1787 substances for HL and <i>V</i><sub>d</sub>, respectively, and considered two different chemical featurization methods. We employed five individual algorithms (Support Vector Regression, Random Forest, Gaussian Process, Artificial Neural Network, and Extreme Gradient Boosting) to construct the base models, and then combined predictions using Multiple Linear Regression to obtain 4 stacking models. Our stacking models performed well and outperformed the corresponding base models, with the extended connectivity fingerprint-based stacking model achieving the best predictive performance. The accuracy of the models, as defined by the applicability domain, was further improved, retaining more than 60% of the test data. Finally, we developed a publicly accessible online Web site (http://tkpara.hhra.net), where users can easily and quickly utilize our models. Our work provides data support for human health risk assessment of chemicals and for the use and management of chemicals or industrial products.</p>","PeriodicalId":73648,"journal":{"name":"Journal of chemical health & safety","volume":"32 6","pages":"810–825"},"PeriodicalIF":3.4,"publicationDate":"2025-11-10","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"145575785","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
The rapid and accurate localization of hazardous chemical leak sources is critical for mitigating environmental damage, protecting public health, and ensuring an effective emergency response. However, the conventional source localization method can be slow and inefficient. To address this challenge, this research proposes and develops a novel integrated system leveraging computational fluid dynamics (CFD), sensor network optimization, and artificial neural networks (ANN) for the precise localization of chemical sources, focusing on ethanol leaks within a laboratory environment. The dispersion of ethanol gas was simulated using CFD, and the simulation data were used for sensor optimization. The sensor system, consisting of 10 sensors at vital locations, is the foundation for the development of the ANN-based source localization method. The environmental factors related to gas dispersion considered were wind speed, wind direction, and temperature, as well as the presence of exhaust and air supply systems. A total of 4 leakage points were studied. The concentration data measured by the sensor system were used to train the ANN to identify the most probable location of the ethanol leak. The model achieved a validation percentage of 87.5% and an average error of 0.0001% in determining the ethanol leak location of four release points in the study area. The findings demonstrate that this combined CFD-ML approach offers a powerful and efficient tool for improving emergency response protocols, enhancing safety measures, and mitigating potential financial losses during chemical incidents.
{"title":"Quantitative Risk-Informed Sensor Placement Optimization for Chemical Leak Detection in a Complex Laboratory Layout Using the CFD-ANN Approach","authors":"Xu Zhang, , , Michelle Xin Yi Ng, , , Kai Xiang Yu, , , Joon Yoon Ten, , , Khang Wei Tan, , , Weng Hoong Lam, , , Peng Chee Tan, , , Thomas Shean Yaw Choong, , , Parthiban Siwayanan, , , Kek Seong Kim*, , and , Zhen Hong Ban*, ","doi":"10.1021/acs.chas.5c00089","DOIUrl":"https://doi.org/10.1021/acs.chas.5c00089","url":null,"abstract":"<p >The rapid and accurate localization of hazardous chemical leak sources is critical for mitigating environmental damage, protecting public health, and ensuring an effective emergency response. However, the conventional source localization method can be slow and inefficient. To address this challenge, this research proposes and develops a novel integrated system leveraging computational fluid dynamics (CFD), sensor network optimization, and artificial neural networks (ANN) for the precise localization of chemical sources, focusing on ethanol leaks within a laboratory environment. The dispersion of ethanol gas was simulated using CFD, and the simulation data were used for sensor optimization. The sensor system, consisting of 10 sensors at vital locations, is the foundation for the development of the ANN-based source localization method. The environmental factors related to gas dispersion considered were wind speed, wind direction, and temperature, as well as the presence of exhaust and air supply systems. A total of 4 leakage points were studied. The concentration data measured by the sensor system were used to train the ANN to identify the most probable location of the ethanol leak. The model achieved a validation percentage of 87.5% and an average error of 0.0001% in determining the ethanol leak location of four release points in the study area. The findings demonstrate that this combined CFD-ML approach offers a powerful and efficient tool for improving emergency response protocols, enhancing safety measures, and mitigating potential financial losses during chemical incidents.</p>","PeriodicalId":73648,"journal":{"name":"Journal of chemical health & safety","volume":"32 6","pages":"716–736"},"PeriodicalIF":3.4,"publicationDate":"2025-11-04","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"145575808","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Institute of Science Tokyo has been actively conducting safety and health risk assessments (RA) across its science and engineering laboratories. Prior studies indicated a negative association between RA implementation rates and accident occurrence, suggesting that thorough RA practices can effectively reduce risks. Notably, hazards such as glassware and cutting tools were associated with higher accident rates, primarily resulting in cuts and puncture wounds. Effective RA requires concrete damage scenario assumptions and prioritization of engineering controls over worker-dependent measures. In August 2024, a chlorine gas leak incident occurred on campus due to a valve malfunction in an unused and uninspected gas cylinder. Despite the absence of injuries, the incident highlighted the need for enhanced preventive strategies. This study analyzes the high-pressure gas accidents that occurred over the past 20 years and assesses whether current RA practices adequately address these risks, with the goal of enhancing future safety strategies. During this time, seven high-pressure gas accidents were reported (five leaks, two ruptures), averaging 0.4 cases per year─significantly fewer than chemical-related incidents (285 cases, 14.3/year). In 2024, 49% of laboratories possessing gas cylinders conducted RA. Laboratories assessing toxic gases and predicting poisoning implemented more countermeasures, with a notable focus on engineering controls, reflecting greater hazard awareness. However, incomplete RA, as seen in the 2024 incident, may hinder the goal of zero accidents. The lack of regular inspections and aging infrastructure (pipes, valves, flanges) emerged as critical issues. These findings offer valuable insights for global institutions seeking to improve high-pressure gas safety and risk management.
{"title":"Investigative Analysis of Safety Risk Assessment in University Science and Engineering Laboratories: Focus on High-Pressure Gas Accident","authors":"Hiroko Kato, , , Masako Iwasaki, , , Takayuki Sunazaki, , , Shinichi Daiten, , and , Yukitoshi Takeshita*, ","doi":"10.1021/acs.chas.5c00127","DOIUrl":"https://doi.org/10.1021/acs.chas.5c00127","url":null,"abstract":"<p >Institute of Science Tokyo has been actively conducting safety and health risk assessments (RA) across its science and engineering laboratories. Prior studies indicated a negative association between RA implementation rates and accident occurrence, suggesting that thorough RA practices can effectively reduce risks. Notably, hazards such as glassware and cutting tools were associated with higher accident rates, primarily resulting in cuts and puncture wounds. Effective RA requires concrete damage scenario assumptions and prioritization of engineering controls over worker-dependent measures. In August 2024, a chlorine gas leak incident occurred on campus due to a valve malfunction in an unused and uninspected gas cylinder. Despite the absence of injuries, the incident highlighted the need for enhanced preventive strategies. This study analyzes the high-pressure gas accidents that occurred over the past 20 years and assesses whether current RA practices adequately address these risks, with the goal of enhancing future safety strategies. During this time, seven high-pressure gas accidents were reported (five leaks, two ruptures), averaging 0.4 cases per year─significantly fewer than chemical-related incidents (285 cases, 14.3/year). In 2024, 49% of laboratories possessing gas cylinders conducted RA. Laboratories assessing toxic gases and predicting poisoning implemented more countermeasures, with a notable focus on engineering controls, reflecting greater hazard awareness. However, incomplete RA, as seen in the 2024 incident, may hinder the goal of zero accidents. The lack of regular inspections and aging infrastructure (pipes, valves, flanges) emerged as critical issues. These findings offer valuable insights for global institutions seeking to improve high-pressure gas safety and risk management.</p>","PeriodicalId":73648,"journal":{"name":"Journal of chemical health & safety","volume":"32 6","pages":"768–779"},"PeriodicalIF":3.4,"publicationDate":"2025-10-29","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://pubs.acs.org/doi/pdf/10.1021/acs.chas.5c00127","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"145575832","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}
Pub Date : 2025-10-03DOI: 10.1021/acs.chas.5c00094
Faris Abdullah, , , Mohd. Hafiidz Jaafar*, , , Mardiana Idayu Ahmad, , and , Mohd Saiful Samsudin,
Chemical Health Risk Assessment (CHRA) and Indoor Air Quality (IAQ) assessments are important aspects of assessment to be conducted in chemical laboratories. A local higher education institution was selected for the purpose of this study. The objective of this study is to propose an integrated approach that combines IAQ monitoring with CHRA to enhance the accuracy and effectiveness of chemical risk assessments in Malaysian academic laboratories under the provision of the OSHA 1994. 79 laboratories had undergone a thorough chemical health risk assessment based on the requirements of the Use and Standards Exposure of Chemicals Hazardous to Health Regulation (2000). Thirty-four laboratories were later selected and underwent further analysis using an Indoor Air Quality assessment based on the Malaysian Industrial Code of Practice on Indoor Air Quality (2010). Parameters such as relative humidity and ventilation indicator (carbon dioxide) were found to be significantly associated with Action Priority (AP-risk level) using the CHRA methodology at a 5% significance level. Integrating IAQ parameters with CHRA offers a more comprehensive, data-driven approach to identifying and managing chemical exposure risks in Malaysian academic laboratories.
{"title":"Enhancing Chemical Health Risk Assessment Practices in a Malaysian Higher Academic Institution through Indoor Air Quality Methodology: Mixed-Method Analysis","authors":"Faris Abdullah, , , Mohd. Hafiidz Jaafar*, , , Mardiana Idayu Ahmad, , and , Mohd Saiful Samsudin, ","doi":"10.1021/acs.chas.5c00094","DOIUrl":"https://doi.org/10.1021/acs.chas.5c00094","url":null,"abstract":"<p >Chemical Health Risk Assessment (CHRA) and Indoor Air Quality (IAQ) assessments are important aspects of assessment to be conducted in chemical laboratories. A local higher education institution was selected for the purpose of this study. The objective of this study is to propose an integrated approach that combines IAQ monitoring with CHRA to enhance the accuracy and effectiveness of chemical risk assessments in Malaysian academic laboratories under the provision of the OSHA 1994. 79 laboratories had undergone a thorough chemical health risk assessment based on the requirements of the Use and Standards Exposure of Chemicals Hazardous to Health Regulation (2000). Thirty-four laboratories were later selected and underwent further analysis using an Indoor Air Quality assessment based on the Malaysian Industrial Code of Practice on Indoor Air Quality (2010). Parameters such as relative humidity and ventilation indicator (carbon dioxide) were found to be significantly associated with Action Priority (AP-risk level) using the CHRA methodology at a 5% significance level. Integrating IAQ parameters with CHRA offers a more comprehensive, data-driven approach to identifying and managing chemical exposure risks in Malaysian academic laboratories.</p>","PeriodicalId":73648,"journal":{"name":"Journal of chemical health & safety","volume":"32 6","pages":"737–749"},"PeriodicalIF":3.4,"publicationDate":"2025-10-03","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"145575833","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 2025-10-03DOI: 10.1021/acs.chas.5c00088
Libe Vilela*, , , Anders Blom, , , Gunilla Runström Eden, , , Håkan Tinnerberg, , , Anne Farbrot, , , Anneli Julander, , and , Linda Schenk,
Purpose: exposure to cleaning work has been associated with adverse effects on skin and the respiratory tract. However, quantitative data on exposure to chemicals among cleaning personnel are limited. We aimed to develop a new approach for cleaning chemical exposure quantification and to characterize cleaning personnel’s work environment. Methods: cleaning personnel (n = 12) from three workplaces participated. Personal air samples were collected with a 25 mm filter cassette containing an active adsorbent sample disc. Samples were analyzed with Gas Chromatography–Mass Spectrometry (GC–MS) in two ways, a fingerprint-based quantification and a nontarget screening to identify the range of chemicals. DataRAM pDR 1000AN was used to monitor particle peaks (1–10 μm). Additional information, such as glove use and health symptoms, was collected via questionnaires, diaries, and observations. Nasal patency was assessed using peak nasal inspiratory flow (PNIF) pre- and postshift. Results: Chemical exposures varied within and between cleaning personnel and between workplaces. Fifty-five chemicals were identified across the air samples, 21 of which were also found in analyzed products. Constituents from spray products were more often detected than from nonspray products. Peak exposures to particles were identified during bathroom cleaning or spray use. Cleaning personnel with self-reported respiratory allergies had lower PNIF values than other cleaners (p = 0.016). Workplace observations indicate an extremely long duration of glove use. Conclusion: This study successfully implemented a GC–MS-based chemical analysis, showing high variation in both amounts and chemical ranges between cleaning personnel. Estimated air concentrations were low compared to the Swedish occupational exposure limits. Use of occlusive gloves was high.
{"title":"Characterizing Cleaners’ Exposures to Chemicals in Cleaning Products Using Gas Chromatography–Mass Spectrometry Fingerprinting: A Feasibility Study","authors":"Libe Vilela*, , , Anders Blom, , , Gunilla Runström Eden, , , Håkan Tinnerberg, , , Anne Farbrot, , , Anneli Julander, , and , Linda Schenk, ","doi":"10.1021/acs.chas.5c00088","DOIUrl":"https://doi.org/10.1021/acs.chas.5c00088","url":null,"abstract":"<p >Purpose: exposure to cleaning work has been associated with adverse effects on skin and the respiratory tract. However, quantitative data on exposure to chemicals among cleaning personnel are limited. We aimed to develop a new approach for cleaning chemical exposure quantification and to characterize cleaning personnel’s work environment. Methods: cleaning personnel (<i>n</i> = 12) from three workplaces participated. Personal air samples were collected with a 25 mm filter cassette containing an active adsorbent sample disc. Samples were analyzed with Gas Chromatography–Mass Spectrometry (GC–MS) in two ways, a fingerprint-based quantification and a nontarget screening to identify the range of chemicals. DataRAM pDR 1000AN was used to monitor particle peaks (1–10 μm). Additional information, such as glove use and health symptoms, was collected via questionnaires, diaries, and observations. Nasal patency was assessed using peak nasal inspiratory flow (PNIF) pre- and postshift. Results: Chemical exposures varied within and between cleaning personnel and between workplaces. Fifty-five chemicals were identified across the air samples, 21 of which were also found in analyzed products. Constituents from spray products were more often detected than from nonspray products. Peak exposures to particles were identified during bathroom cleaning or spray use. Cleaning personnel with self-reported respiratory allergies had lower PNIF values than other cleaners (<i>p</i> = 0.016). Workplace observations indicate an extremely long duration of glove use. Conclusion: This study successfully implemented a GC–MS-based chemical analysis, showing high variation in both amounts and chemical ranges between cleaning personnel. Estimated air concentrations were low compared to the Swedish occupational exposure limits. Use of occlusive gloves was high.</p>","PeriodicalId":73648,"journal":{"name":"Journal of chemical health & safety","volume":"32 6","pages":"705–715"},"PeriodicalIF":3.4,"publicationDate":"2025-10-03","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://pubs.acs.org/doi/pdf/10.1021/acs.chas.5c00088","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"145575835","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}
Pub Date : 2025-10-01DOI: 10.1021/acs.chas.5c00138
Aleksandr B. Stefaniak*, , , Lauren N. Bowers, , , Christopher Barnes, , , Elizabeth D. Brusak, , , Cornelius Petrus Kloppers, , , Sonette Du Preez, , , Sherri Friend, , and , Johan L. Du Plessis,
Billions of plastic bags (PBs) are consumed per day and are discarded after use. One way to reduce PB waste is distributed recycling and conversion into filament for 3-D printing as part of a circular economy, though little is understood about emissions during these processes. Herein, a “green” method was used to mix high-density polyethylene (HDPE) PBs from South Africa or the United States with virgin HDPE and extrude into filaments that were used to 3-D print tensile test specimens. Particle- and gas-phase emissions were measured throughout processing. On a particle number basis, during filament production, emissions mostly had sizes 1.2–5.2 nm, whereas during 3-D printing, emissions were mostly 5.6–560 nm. Particle yields (no./g plastic processed) were significantly (2–3 orders of magnitude) higher during 3-D printing compared with filament making. Acetone (range: 1.4–39.4 μg/g printed) and formaldehyde (range: 9.9–16.1 μg/g printed), the latter a potential occupational carcinogen, were released during 3-D printing. The Young’s modulus of test specimens was comparable to literature values for 3-D-printed virgin and recycled HDPE. Recycling waste PBs into filament for 3-D printing has myriad sustainability benefits, though the potential for human exposures to particles and gases is an important consideration for future life cycle analyses.
{"title":"Recycling Plastic Bags into Filament: Consideration of Emissions during Melting, Extrusion, and 3-D Printing","authors":"Aleksandr B. Stefaniak*, , , Lauren N. Bowers, , , Christopher Barnes, , , Elizabeth D. Brusak, , , Cornelius Petrus Kloppers, , , Sonette Du Preez, , , Sherri Friend, , and , Johan L. Du Plessis, ","doi":"10.1021/acs.chas.5c00138","DOIUrl":"https://doi.org/10.1021/acs.chas.5c00138","url":null,"abstract":"<p >Billions of plastic bags (PBs) are consumed per day and are discarded after use. One way to reduce PB waste is distributed recycling and conversion into filament for 3-D printing as part of a circular economy, though little is understood about emissions during these processes. Herein, a “green” method was used to mix high-density polyethylene (HDPE) PBs from South Africa or the United States with virgin HDPE and extrude into filaments that were used to 3-D print tensile test specimens. Particle- and gas-phase emissions were measured throughout processing. On a particle number basis, during filament production, emissions mostly had sizes 1.2–5.2 nm, whereas during 3-D printing, emissions were mostly 5.6–560 nm. Particle yields (no./g plastic processed) were significantly (2–3 orders of magnitude) higher during 3-D printing compared with filament making. Acetone (range: 1.4–39.4 μg/g printed) and formaldehyde (range: 9.9–16.1 μg/g printed), the latter a potential occupational carcinogen, were released during 3-D printing. The Young’s modulus of test specimens was comparable to literature values for 3-D-printed virgin and recycled HDPE. Recycling waste PBs into filament for 3-D printing has myriad sustainability benefits, though the potential for human exposures to particles and gases is an important consideration for future life cycle analyses.</p>","PeriodicalId":73648,"journal":{"name":"Journal of chemical health & safety","volume":"32 6","pages":"791–800"},"PeriodicalIF":3.4,"publicationDate":"2025-10-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"145575821","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
A novel electrochemical sensor based on aminobenzenesulfonate-functionalized silicon carbide (SiC) nanoparticles and graphene on a glassy carbon electrode (denoted as GC/Gr/SiC@ABS) was developed for the sensitive detection of nitroaromatic explosives, such as p-nitrophenol (p-NP), 2,4-dinitrophenol (2,4-DNP), 2,4-dinitrotoluene (2,4-DNT), and 2,4,6-trinitrotoluene (TNT). The high electron mobility in graphene, chemical stability of SiC nanoparticles, and modification with aminobenzenesulfonate have a synergistic effect to facilitate and enhance the electrocatalytic reduction of nitroaromatics at acidic pH (1.0). Using cyclic voltammetry, differential pulse voltammetry, and hydrodynamic amperometry, a detection limit of 95 nM, a sensitivity of 1.31 μA μM–1 cm–2, and a linear range of 0.5–20 μM for TNT were achieved. The superior sensitivity and selectivity of the designed sensor make it an expandable, cost-effective option for environmental and safety monitoring of nitroaromatic explosives.
{"title":"Highly Sensitive Electrochemical Sensors for Nitroexplosives Using Functionalized SiC Nanoparticles","authors":"Elham Soltani, , , Rahman Hallaj*, , and , Zhaleh Ghafary, ","doi":"10.1021/acs.chas.5c00112","DOIUrl":"https://doi.org/10.1021/acs.chas.5c00112","url":null,"abstract":"<p >A novel electrochemical sensor based on aminobenzenesulfonate-functionalized silicon carbide (SiC) nanoparticles and graphene on a glassy carbon electrode (denoted as GC/Gr/SiC@ABS) was developed for the sensitive detection of nitroaromatic explosives, such as <i>p</i>-nitrophenol (<i>p</i>-NP), 2,4-dinitrophenol (2,4-DNP), 2,4-dinitrotoluene (2,4-DNT), and 2,4,6-trinitrotoluene (TNT). The high electron mobility in graphene, chemical stability of SiC nanoparticles, and modification with aminobenzenesulfonate have a synergistic effect to facilitate and enhance the electrocatalytic reduction of nitroaromatics at acidic pH (1.0). Using cyclic voltammetry, differential pulse voltammetry, and hydrodynamic amperometry, a detection limit of 95 nM, a sensitivity of 1.31 μA μM<sup>–1</sup> cm<sup>–2</sup>, and a linear range of 0.5–20 μM for TNT were achieved. The superior sensitivity and selectivity of the designed sensor make it an expandable, cost-effective option for environmental and safety monitoring of nitroaromatic explosives.</p>","PeriodicalId":73648,"journal":{"name":"Journal of chemical health & safety","volume":"32 6","pages":"756–767"},"PeriodicalIF":3.4,"publicationDate":"2025-10-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"145575820","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 2025-09-30DOI: 10.1021/acs.chas.5c00083
Daniel T. de Lill, and , Veljko Dragojlovic*,
A catalytic photochemical methoxycarbonylation of iodocyclohexane was carried out as an undergraduate exercise as a part of a Course-based Undergraduate Research Experience (CURE). The main goal of the exercise was to train students, using carbon monoxide as an example, in the design of a process that requires the use of hazardous reagents. The main concept to convey to the students was that the procedure or the process must be designed with numerous safety redundancies to ensure that there was no single point of failure. It meant anticipating possible problems and implementing redundant safety measures and means to detect that a possible problem has occurred.
{"title":"Safe Use of Carbon Monoxide in the Undergraduate Teaching Laboratory: Methoxycarbonylation of Iodocyclohexane","authors":"Daniel T. de Lill, and , Veljko Dragojlovic*, ","doi":"10.1021/acs.chas.5c00083","DOIUrl":"https://doi.org/10.1021/acs.chas.5c00083","url":null,"abstract":"<p >A catalytic photochemical methoxycarbonylation of iodocyclohexane was carried out as an undergraduate exercise as a part of a Course-based Undergraduate Research Experience (CURE). The main goal of the exercise was to train students, using carbon monoxide as an example, in the design of a process that requires the use of hazardous reagents. The main concept to convey to the students was that the procedure or the process must be designed with numerous safety redundancies to ensure that there was no single point of failure. It meant anticipating possible problems and implementing redundant safety measures and means to detect that a possible problem has occurred.</p>","PeriodicalId":73648,"journal":{"name":"Journal of chemical health & safety","volume":"32 6","pages":"690–695"},"PeriodicalIF":3.4,"publicationDate":"2025-09-30","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"145575812","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 2025-09-25DOI: 10.1021/acs.chas.5c00105
Hans. R. Kricheldorf*, and , Steffen M. Weidner,
This article reviews and discusses information on the toxicity of numerous tin-based catalysts used in academic research and industrial production for the synthesis of various polymers, such as polyesters, polyurethanes, and polysiloxanes. Tin(IV) compounds used as additives and as PVC stabilizers are also considered. Emphasis is put on the differentiation between tin(II) salts on the one hand and tin(IV) compounds on the other hand. In the first chapter, historical facts about human contact with stannous ions are discussed, along with toxicity studies of canned foods and beverages. In the second part, toxicity tests based on cell cultures and medical applications of tin(II)-containing films or implants are described. The third part focuses on alkyl and aryl tin(IV) compounds.
{"title":"About the Toxicity of Polymerization Catalysts and Polymer Additives Based on Tin(II) Salts and Tin(IV) Compounds","authors":"Hans. R. Kricheldorf*, and , Steffen M. Weidner, ","doi":"10.1021/acs.chas.5c00105","DOIUrl":"https://doi.org/10.1021/acs.chas.5c00105","url":null,"abstract":"<p >This article reviews and discusses information on the toxicity of numerous tin-based catalysts used in academic research and industrial production for the synthesis of various polymers, such as polyesters, polyurethanes, and polysiloxanes. Tin(IV) compounds used as additives and as PVC stabilizers are also considered. Emphasis is put on the differentiation between tin(II) salts on the one hand and tin(IV) compounds on the other hand. In the first chapter, historical facts about human contact with stannous ions are discussed, along with toxicity studies of canned foods and beverages. In the second part, toxicity tests based on cell cultures and medical applications of tin(II)-containing films or implants are described. The third part focuses on alkyl and aryl tin(IV) compounds.</p>","PeriodicalId":73648,"journal":{"name":"Journal of chemical health & safety","volume":"32 6","pages":"677–689"},"PeriodicalIF":3.4,"publicationDate":"2025-09-25","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://pubs.acs.org/doi/pdf/10.1021/acs.chas.5c00105","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"145575851","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}
Pub Date : 2025-09-22DOI: 10.1021/acs.chas.5c00152
Pamela Pollet*,
{"title":"The Chemical Exposure Multiverse: Navigating Chemical Hazards through Multidisciplinary Insight","authors":"Pamela Pollet*, ","doi":"10.1021/acs.chas.5c00152","DOIUrl":"https://doi.org/10.1021/acs.chas.5c00152","url":null,"abstract":"","PeriodicalId":73648,"journal":{"name":"Journal of chemical health & safety","volume":"32 5","pages":"530–531"},"PeriodicalIF":3.4,"publicationDate":"2025-09-22","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"145104144","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}