Hao Li, Jin-Xi Wu, Guang-Yuan Zhang, Ning-Ning Du, Le-Wu Zhan, Jing Hou, Bin-Dong Li
{"title":"Thermal Hazard Assessment of the Synthesis of 1,1′-Azobis-1,2,3-triazole","authors":"Hao Li, Jin-Xi Wu, Guang-Yuan Zhang, Ning-Ning Du, Le-Wu Zhan, Jing Hou, Bin-Dong Li","doi":"10.1021/acs.oprd.4c00404","DOIUrl":null,"url":null,"abstract":"Azo energetic compounds have attracted much attention due to their high heat of formation and high oxygen balance. However, due to a lack of safety research on this manufacturing process, industrial production cannot be carried out. 1,1′-Azobis-1,2,3-triazole was chosen as an example to identify hazardous scenarios in the synthesis of azo-energetic materials. First, the properties of the 1,1′-azobis-1,2,3-triazole synthesis experiment were studied using a reaction calorimeter (RC1). Afterward, the thermal stability of the composite materials used in the synthesis process was evaluated using accelerating rate calorimetry (ARC) and differential scanning calorimetry (DSC). DSC results showed that the heat release of the mixture was significantly reduced in all three steps. ARC experiments showed that the <i>T</i><sub>D24</sub> values of the three substances are in the range of 100.00–300.00 °C. RC1 experiments showed that the adiabatic temperature rises (Δ<i>T</i><sub>ad</sub>) in the whole process are 91.26 54.19, 51.49, and 4.10 K, respectively. These findings indicate that the exothermic reaction involved in the synthesis of 1,1′-azobis-1,2,3-triazole is initiated during the dosing phase and is affected by the dosing rate. The overall 1,1′-azobis-1,2,3-triazole synthesis process is a criticality class 1 of a chemical reaction. This holistic approach furnishes valuable data and insights for improving the engineering safety protocols of 1,1′-azobis-1,2,3-triazole, aimed at mitigating risks in industrial operations.","PeriodicalId":55,"journal":{"name":"Organic Process Research & Development","volume":"15 1","pages":""},"PeriodicalIF":3.1000,"publicationDate":"2025-02-19","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"0","resultStr":null,"platform":"Semanticscholar","paperid":null,"PeriodicalName":"Organic Process Research & Development","FirstCategoryId":"92","ListUrlMain":"https://doi.org/10.1021/acs.oprd.4c00404","RegionNum":3,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"Q2","JCRName":"CHEMISTRY, APPLIED","Score":null,"Total":0}
引用次数: 0
Abstract
Azo energetic compounds have attracted much attention due to their high heat of formation and high oxygen balance. However, due to a lack of safety research on this manufacturing process, industrial production cannot be carried out. 1,1′-Azobis-1,2,3-triazole was chosen as an example to identify hazardous scenarios in the synthesis of azo-energetic materials. First, the properties of the 1,1′-azobis-1,2,3-triazole synthesis experiment were studied using a reaction calorimeter (RC1). Afterward, the thermal stability of the composite materials used in the synthesis process was evaluated using accelerating rate calorimetry (ARC) and differential scanning calorimetry (DSC). DSC results showed that the heat release of the mixture was significantly reduced in all three steps. ARC experiments showed that the TD24 values of the three substances are in the range of 100.00–300.00 °C. RC1 experiments showed that the adiabatic temperature rises (ΔTad) in the whole process are 91.26 54.19, 51.49, and 4.10 K, respectively. These findings indicate that the exothermic reaction involved in the synthesis of 1,1′-azobis-1,2,3-triazole is initiated during the dosing phase and is affected by the dosing rate. The overall 1,1′-azobis-1,2,3-triazole synthesis process is a criticality class 1 of a chemical reaction. This holistic approach furnishes valuable data and insights for improving the engineering safety protocols of 1,1′-azobis-1,2,3-triazole, aimed at mitigating risks in industrial operations.
期刊介绍:
The journal Organic Process Research & Development serves as a communication tool between industrial chemists and chemists working in universities and research institutes. As such, it reports original work from the broad field of industrial process chemistry but also presents academic results that are relevant, or potentially relevant, to industrial applications. Process chemistry is the science that enables the safe, environmentally benign and ultimately economical manufacturing of organic compounds that are required in larger amounts to help address the needs of society. Consequently, the Journal encompasses every aspect of organic chemistry, including all aspects of catalysis, synthetic methodology development and synthetic strategy exploration, but also includes aspects from analytical and solid-state chemistry and chemical engineering, such as work-up tools,process safety, or flow-chemistry. The goal of development and optimization of chemical reactions and processes is their transfer to a larger scale; original work describing such studies and the actual implementation on scale is highly relevant to the journal. However, studies on new developments from either industry, research institutes or academia that have not yet been demonstrated on scale, but where an industrial utility can be expected and where the study has addressed important prerequisites for a scale-up and has given confidence into the reliability and practicality of the chemistry, also serve the mission of OPR&D as a communication tool between the different contributors to the field.