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Cyclohexene is an important raw material for nylon production, and the selective hydrogenation of benzene is a key route for preparing cyclohexene. To promote data sharing and reuse in this field, we collected and standardized experimental data on the hydrogenation of benzene to cyclohexene from publicly available literature and constructed a comprehensive dataset containing catalyst composition, reaction conditions, and reaction results (conversion, selectivity and yield). This data descriptor details the source, field definitions, generation and processing workflow, quality control, sharing approach and usage recommendations of the dataset, with the aim of providing a reusable data foundation for subsequent statistical analysis, machine learning modeling, experimental design, and catalyst screening.
, authors=Chao SUN
1, 2, Bin ZHANG
1, *, authorsList=Chao SUN, Bin ZHANG, authorCompany=null, correspAuthors=Bin ZHANG, authorNote=null, correspAuthorsNote=
, copyrightStatement=Copyright ©2026 Journal of Fuel Chemistry and Technology. All rights reserved., copyrightOwner=null, extLink=null, articleAbsUrl=null, sourceXml=2mL4yNp2XJOSjPBV6vhpFw==, magXml=cYJSZ0+QpyE4zgHnm7K4bQ==, pdfUrl=null, pdf=Y6125iB3deKkTk7WMewoHw==, pdfFileSize=3050984, pdfExtLink=null, richHtmlUrl=null, mobilePdfUrl=null, reviewReport=null, pdfFirstPage=null, abstractGraph=PeKfVU6ZUUmE23ZdSNnw6A==, abstractGraphContent=null, abstractVideo=null, citation=null, cebUrl=null, magXmlContent=k7GbGSAK6VYwRfIGZz30FQ==, mapNumber=null, fund=null), CN=ArticleExt(id=1309631245466821406, articleId=1309631244078506770, tenantId=1146029695717560320, journalId=1308397254396182630, language=CN, title=苯选择性加氢制环己烯反应数据集的收集、处理与共享, columnId=null, journalTitle=燃料化学学报(中英文), columnName=null, runingTitle=null, highlight=null, articleAbstract=
环己烯是尼龙生产的重要原料,而苯的选择性加氢是制备环己烯的关键途径。为促进该领域的数据共享与复用,本工作从公开发表文献中收集并标准化整理苯加氢生成环己烯反应的实验数据,构建了一个包含催化剂组成、反应条件与反应结果(转化率、选择性、产率)的综合数据集。本文以数据论文形式介绍数据集的来源、字段定义、生成与处理流程、质量控制、共享方式和使用建议,旨在为后续的统计分析、机器学习建模、实验设计与催化剂筛选提供可复用的数据基础。
, authors=孙超
1, 2, 张斌
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1, 2, address=
1State Key Laboratory of Coal Conversion, Institute of Coal Chemistry, Chinese Academy of Sciences, Taiyuan 030001, China
2Center for Materials Science and Optoelectronics Engineering, University of Chinese Academy of Sciences, Beijing 100049, China, bio=null, bioImg=null, bioContent=null, aboutCorrespAuthor=null), CN=AuthorExt(id=1309631246129521450, tenantId=1146029695717560320, journalId=1308397254396182630, articleId=1309631244078506770, authorId=1309631245840114470, language=CN, stringName=孙超, firstName=null, middleName=null, lastName=null, prefix=null, suffix=null, authorComment=null, nameInitials=null, affiliation=null, department=null, xref=
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1中国科学院山西煤炭化学研究所 煤炭高效低碳利用全国重点实验室, 山西 太原 030001
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1State Key Laboratory of Coal Conversion, Institute of Coal Chemistry, Chinese Academy of Sciences, Taiyuan 030001, China, bio=null, bioImg=null, bioContent=null, aboutCorrespAuthor=null), CN=AuthorExt(id=1309631246372791087, tenantId=1146029695717560320, journalId=1308397254396182630, articleId=1309631244078506770, authorId=1309631246192436012, language=CN, stringName=张斌, firstName=null, middleName=null, lastName=null, prefix=null, suffix=null, authorComment=null, nameInitials=null, affiliation=null, department=null, xref=
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1中国科学院山西煤炭化学研究所 煤炭高效低碳利用全国重点实验室, 山西 太原 030001, bio=null, bioImg=null, bioContent=null, aboutCorrespAuthor=null)}, companyList=[AuthorCompany(id=1309631245676536607, tenantId=1146029695717560320, journalId=1308397254396182630, articleId=1309631244078506770, xref=1, ext=[AuthorCompanyExt(id=1309631245684925216, tenantId=1146029695717560320, journalId=1308397254396182630, articleId=1309631244078506770, companyId=1309631245676536607, language=EN, country=null, province=null, city=null, postcode=null, companyName=null, departmentName=null, remark=
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2catalysts for benzene selective hydrogenation[J]. Catal Sci Technol, 2018, 8: 1435−1446., articleTitle=null, refAbstract=null), Reference(id=1309631249954726724, tenantId=1146029695717560320, journalId=1308397254396182630, articleId=1309631244078506770, doi=null, pmid=null, pmcid=null, year=null, volume=null, issue=null, pageStart=null, pageEnd=null, url=null, language=null, rfNumber=3, rfOrder=2, authorNames=null, journalName=null, refType=null, unstructuredReference=WU T, ZHANG P, JIANG T, et al. Enhancing the selective hydrogenation of benzene to cyclohexene over Ru/TiO
2 catalyst in the presence of a very small amount of ZnO[J]. Sci China: Chem, 2014, 58: 93−100., articleTitle=null, refAbstract=null), Reference(id=1309631250042807109, tenantId=1146029695717560320, journalId=1308397254396182630, articleId=1309631244078506770, doi=null, pmid=null, pmcid=null, year=null, volume=null, issue=null, pageStart=null, pageEnd=null, url=null, language=null, rfNumber=4, rfOrder=3, authorNames=null, journalName=null, refType=null, unstructuredReference=HAO F, ZHENG J, OUYANG D, et al. Selective hydrogenation of benzene over Ru supported on surface modified TiO
2[J]. Korean J Chem Eng, 2021, 38: 736−746., articleTitle=null, refAbstract=null), Reference(id=1309631250147664711, tenantId=1146029695717560320, journalId=1308397254396182630, articleId=1309631244078506770, doi=null, pmid=null, pmcid=null, year=null, volume=null, issue=null, pageStart=null, pageEnd=null, url=null, language=null, rfNumber=5, rfOrder=4, authorNames=null, journalName=null, refType=null, unstructuredReference=ZHOU G, WANG F, SHI R. Nanoparticulate Ru on morphology-manipulated and Ti
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2 nanosheets for benzene semi-hydrogenation[J]. J Catal, 2021, 398: 148−160., articleTitle=null, refAbstract=null), Reference(id=1309631250218967880, tenantId=1146029695717560320, journalId=1308397254396182630, articleId=1309631244078506770, doi=null, pmid=null, pmcid=null, year=null, volume=null, issue=null, pageStart=null, pageEnd=null, url=null, language=null, rfNumber=6, rfOrder=5, authorNames=null, journalName=null, refType=null, unstructuredReference=ZHOU G, DOU R, BI H, et al. Ru nanoparticles on rutile/anatase junction of P25 TiO
2: Controlled deposition and synergy in partial hydrogenation of benzene to cyclohexene[J]. J Catal, 2015, 332: 119−126., articleTitle=null, refAbstract=null), Reference(id=1309631250286076745, tenantId=1146029695717560320, journalId=1308397254396182630, articleId=1309631244078506770, doi=null, pmid=null, pmcid=null, year=null, volume=null, issue=null, pageStart=null, pageEnd=null, url=null, language=null, rfNumber=7, rfOrder=6, authorNames=null, journalName=null, refType=null, unstructuredReference=YAN X, ZHANG Q, ZHU M, et al. Selective hydrogenation of benzene to cyclohexene over Ru–Zn/ZrO
2 catalysts prepared by a two-step impregnation method[J]. J Mol Catal A: Chem, 2016, 413: 85−93., articleTitle=null, refAbstract=null), Reference(id=1309631250357379914, tenantId=1146029695717560320, journalId=1308397254396182630, articleId=1309631244078506770, doi=null, pmid=null, pmcid=null, year=null, volume=null, issue=null, pageStart=null, pageEnd=null, url=null, language=null, rfNumber=8, rfOrder=7, authorNames=null, journalName=null, refType=null, unstructuredReference=WANG Z, ZHANG Q, LU X, et al. Ru-Zn catalysts for selective hydrogenation of benzene using coprecipitation in low alkalinity[J]. Chin J Catal, 2015, 36: 400−407., articleTitle=null, refAbstract=null), Reference(id=1309631250432877387, tenantId=1146029695717560320, journalId=1308397254396182630, articleId=1309631244078506770, doi=null, pmid=null, pmcid=null, year=null, volume=null, issue=null, pageStart=null, pageEnd=null, url=null, language=null, rfNumber=9, rfOrder=8, authorNames=null, journalName=null, refType=null, unstructuredReference=SUN H, WANG H, JIANG H, et al. Effect of (Zn(OH)
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5 on the performance of Ru-Zn catalyst for benzene selective hydrogenation to cyclohexene[J]. Appl Catal A: Gen, 2013, 450: 160−168., articleTitle=null, refAbstract=null), Reference(id=1309631250504180556, tenantId=1146029695717560320, journalId=1308397254396182630, articleId=1309631244078506770, doi=null, pmid=null, pmcid=null, year=null, volume=null, issue=null, pageStart=null, pageEnd=null, url=null, language=null, rfNumber=10, rfOrder=9, authorNames=null, journalName=null, refType=null, unstructuredReference=XUE X, LIU J, RAO D, et al. Double-active site synergistic catalysis in Ru-TiO
2 toward benzene hydrogenation to cyclohexene with largely enhanced selectivity[J]. Catal Sci Technol, 2017, 7: 650−657., articleTitle=null, refAbstract=null)], funds=null, companyList=[AuthorCompany(id=1309631245676536607, tenantId=1146029695717560320, journalId=1308397254396182630, articleId=1309631244078506770, xref=1, ext=[AuthorCompanyExt(id=1309631245684925216, tenantId=1146029695717560320, journalId=1308397254396182630, articleId=1309631244078506770, companyId=1309631245676536607, language=EN, country=null, province=null, city=null, postcode=null, companyName=null, departmentName=null, remark=
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Overview of basic information of the dataset
, figureFileSmall=null, figureFileBig=null, tableContent=
| Item | Description |
|---|
| Data title | Experimental dataset for the selective hydrogenation of benzene to cyclohexene |
| Data version | V1.0 (compiled and standardized in 2025) |
| Author’s name | SUN Chao, ZHANG Bin |
| Corresponding author’s name | ZHANG Bin |
| Data content description | Each record corresponds to one experimental combination and contains the catalyst preparation method, catalyst composition (Ru, Cu, ZnO, NaOH, ZnSO4, AlOOH, SiO2, TiO2, etc.), reaction conditions (temperature, pressure, reaction time, feed ratio, etc.), and performance indicators (conversion, selectivity, and yield). |
| Data generation time | The data were derived from published literature reports, and the present compilation and standardized processing were completed in 2025. |
| Data volume | 178 experimental records covering catalyst preparation methods, catalyst compositions, reaction conditions, pore-structure descriptors, and performance outputs |
| Data format | Microsoft Excel workbook (.xlsx) |
| Data source location | GitHub: https://github.com/ttoono-takaki/Code-and-dataset.git; Science Data Bank: https://doi.org/10.57760/sciencedb.27385 |
| Funding information | Strategic Priority Research Program of the Chinese Academy of Sciences (XDB1190000), and the General Program of the National Natural Science Foundation of China (22572209) |
| Citation format of data | SUN Chao, ZHANG Bin. Experimental dataset for the selective hydrogenation of benzene to cyclohexene[J]. J Fuel Chem Technol, 2026, 54(7): 20260027. SUN Chao, ZHANG Bin. Experimental dataset for the selective hydrogenation of benzene to cyclohexene[DS/OL]. V1. Science Data Bank, 2025[2026-06-05]. https://doi.org/10.57760/sciencedb.27385. DOI:10.57760/sciencedb.27385. |
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| Item | Description |
|---|
| Data title | Experimental dataset for the selective hydrogenation of benzene to cyclohexene |
| Data version | V1.0 (compiled and standardized in 2025) |
| Author’s name | SUN Chao, ZHANG Bin |
| Corresponding author’s name | ZHANG Bin |
| Data content description | Each record corresponds to one experimental combination and contains the catalyst preparation method, catalyst composition (Ru, Cu, ZnO, NaOH, ZnSO4, AlOOH, SiO2, TiO2, etc.), reaction conditions (temperature, pressure, reaction time, feed ratio, etc.), and performance indicators (conversion, selectivity, and yield). |
| Data generation time | The data were derived from published literature reports, and the present compilation and standardized processing were completed in 2025. |
| Data volume | 178 experimental records covering catalyst preparation methods, catalyst compositions, reaction conditions, pore-structure descriptors, and performance outputs |
| Data format | Microsoft Excel workbook (.xlsx) |
| Data source location | GitHub: https://github.com/ttoono-takaki/Code-and-dataset.git; Science Data Bank: https://doi.org/10.57760/sciencedb.27385 |
| Funding information | Strategic Priority Research Program of the Chinese Academy of Sciences (XDB1190000), and the General Program of the National Natural Science Foundation of China (22572209) |
| Citation format of data | SUN Chao, ZHANG Bin. Experimental dataset for the selective hydrogenation of benzene to cyclohexene[J]. J Fuel Chem Technol, 2026, 54(7): 20260027. SUN Chao, ZHANG Bin. Experimental dataset for the selective hydrogenation of benzene to cyclohexene[DS/OL]. V1. Science Data Bank, 2025[2026-06-05]. https://doi.org/10.57760/sciencedb.27385. DOI:10.57760/sciencedb.27385. |
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Examples of the main variables in the dataset and their value ranges
, figureFileSmall=null, figureFileBig=null, tableContent=
| Variable | Unit/Type | Example value range |
|---|
| Benzene/water | mL/mL | 0.175–0.5 |
| Benzene/catalyst | mL/mg | 0.05–0.3846 |
| Pretreatment temperature | K | 298–873 |
| Reduction temperature | K | 298–573 |
| Hydrogen concentration | % | 0/5/99.9 |
| Reduction time | h | 0–3 |
| Reaction temperature | K | 373–453 |
| Reaction time | min | 1–720 |
| Reaction pressure | MPa | 2–7 |
| SBET | m2/g | 8.4–318 |
| Dpore | nm | 2.63–42.2 |
| vpore | cm3/g | 0.03–1.05 |
| VHSV | mL/(mg·h) | 0.00058–11.538 |
| Ru | % | 0.18–20 |
| Cu | % | 0–1.26 |
| ZnO | % | 0–97.93 |
| NaOH | % | 0–93.26 |
| ZnSO4 | % | 0–90.99 |
| AlOOH | % | 0–43.68 |
| SiO2 | % | 0–43.68 |
| TiO2 | % | 0–97.1 |
| Selectivity | % | 0.7–89.3 |
| Yield | % | 0.3–60.64 |
| Conversion | % | 4.04–98.58 |
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| Variable | Unit/Type | Example value range |
|---|
| Benzene/water | mL/mL | 0.175–0.5 |
| Benzene/catalyst | mL/mg | 0.05–0.3846 |
| Pretreatment temperature | K | 298–873 |
| Reduction temperature | K | 298–573 |
| Hydrogen concentration | % | 0/5/99.9 |
| Reduction time | h | 0–3 |
| Reaction temperature | K | 373–453 |
| Reaction time | min | 1–720 |
| Reaction pressure | MPa | 2–7 |
| SBET | m2/g | 8.4–318 |
| Dpore | nm | 2.63–42.2 |
| vpore | cm3/g | 0.03–1.05 |
| VHSV | mL/(mg·h) | 0.00058–11.538 |
| Ru | % | 0.18–20 |
| Cu | % | 0–1.26 |
| ZnO | % | 0–97.93 |
| NaOH | % | 0–93.26 |
| ZnSO4 | % | 0–90.99 |
| AlOOH | % | 0–43.68 |
| SiO2 | % | 0–43.68 |
| TiO2 | % | 0–97.1 |
| Selectivity | % | 0.7–89.3 |
| Yield | % | 0.3–60.64 |
| Conversion | % | 4.04–98.58 |
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