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Frontiers of Chemical Science and Engineering

ISSN 2095-0179

ISSN 2095-0187(Online)

CN 11-5981/TQ

邮发代号 80-969

2019 Impact Factor: 3.552

Frontiers of Chemical Science and Engineering  2024, Vol. 18 Issue (1): 5   https://doi.org/10.1007/s11705-023-2375-z
  本期目录
Effect of cis/trans molecular structures on pyrolysis performance and heat sink of decalin isomers
Qing Liu1,2,4, Kang Xue1,2,3,4, Tinghao Jia1, Zhouyang Shen1,2,4, Zehao Han1,2,4, Lun Pan1,2,3,4(), Ji-Jun Zou1,2,3,4, Xiangwen Zhang1,2,3,4()
1. Key Laboratory for Green Chemical Technology of the Ministry of Education, School of Chemical Engineering and Technology, Tianjin University, Tianjin 300072, China
2. Collaborative Innovative Center of Chemical Science and Engineering (Tianjin), Tianjin 300072, China
3. Haihe Laboratory of Sustainable Chemical Transformations, Tianjin 300192, China
4. Zhejiang Institute of Tianjin University, Ningbo 315201, China
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Abstract

Decalin is considered as an important compound of high-energy-density endothermic fuel, which is an ideal on-board coolant for thermal management of advanced aircraft. However, decalin contains two isomers with a tunable composition, and their effects on the pyrolysis performance, such as the heat sink and coking tendency have not been demonstrated. Herein, we investigated the pyrolysis of decalin isomers, i.e., cis-decalin, trans-decalin and their mixtures (denoted as mix-decalin), in order to clarify the effects of the cis-/trans-structures on the pyrolysis performance of decalin fuels. The pyrolysis results confirmed that conversion of the tested fuels (600–725 °C, 4 MPa) decreased in the order cis-decalin > mix-decalin > trans-decalin. Detailed analyses of the pyrolysis products were used to compare the product distributions from cis-decalin, mix-decalin and trans-decalin, and the yields of some typical components (such as cyclohexene, 1-methylcyclohexene, benzene and toluene) showed significant differences, which could be ascribed to deeper cracking of cis-decalin. Additionally, the heat sinks and coking tendencies of the decalins decreased in the order cis-decalin > mix-decalin > trans-decalin. This work demonstrates the relationship between the cis/trans structures and the pyrolysis performance of decalin, which provides a better understanding of the structure-activity relationships of endothermic hydrocarbon fuels.

Key wordsendothermic fuel    decalin    pyrolysis    heat sink    molecular structure
收稿日期: 2023-07-26      出版日期: 2023-12-27
Corresponding Author(s): Lun Pan,Xiangwen Zhang   
 引用本文:   
. [J]. Frontiers of Chemical Science and Engineering, 2024, 18(1): 5.
Qing Liu, Kang Xue, Tinghao Jia, Zhouyang Shen, Zehao Han, Lun Pan, Ji-Jun Zou, Xiangwen Zhang. Effect of cis/trans molecular structures on pyrolysis performance and heat sink of decalin isomers. Front. Chem. Sci. Eng., 2024, 18(1): 5.
 链接本文:  
https://academic.hep.com.cn/fcse/CN/10.1007/s11705-023-2375-z
https://academic.hep.com.cn/fcse/CN/Y2024/V18/I1/5
Fuel cis -decalin mix -decalin trans -decalin
Formula C10H18 C10H18 C10H18
Molecule structure
Density (g·mL–1, 20 °C) 0.897 0.879 0.870
Gravimetric NHOC (MJ·kg–1) 42.7 42.7 42.7
Volumetric NHOC (MJ·L–1) 38.3 37.5 37.1
Kinematic viscosity (mm2·s–1, 20 °C) 3.63 2.71 2.40
Tab.1  
Fig.1  
T/K923948973998
cis-decalin0.28460.45310.76501.024
mix-decalin0.19480.33230.58070.8894
trans-decalin0.16740.18730.50870.6998
Tab.2  
Fig.2  
Fig.3  
Fig.4  
Fig.5  
Fig.6  
Fig.7  
Fig.8  
Fig.9  
  
1 D R Sobel , L J Spadaccini . Hydrocarbon fuel cooling technologies for advanced propulsion. Journal of Engineering for Gas Turbines and Power, 1997, 119(2): 344–351
https://doi.org/10.1115/1.2815581
2 H Huang , L J Spadaccini , D R Sobel . Fuel-cooled thermal management for advanced aeroengines. Journal of Engineering for Gas Turbines and Power, 2004, 126(2): 284–293
https://doi.org/10.1115/1.1689361
3 H HuangD R SobelL J Spadaccini. Endothermic heat-sink of hydrocarbon fuels for scramjet cooling. In: 38th AIAA/ASME/SAE/ASEE Joint Propulsion Conference & Exhibit. Indianapolis, Indiana: American Institute of Aeronautics and Astronautics, 2002, 3871
4 L M Balster , E Corporan , M J Dewitt , J T Edwards , J S Ervin , J L Graham , S Y Lee , S Pal , D K Phelps , L R Rudnick . et al.. Development of an advanced, thermally stable, coal-based jet fuel. Fuel Processing Technology, 2008, 89(4): 364–378
https://doi.org/10.1016/j.fuproc.2007.11.018
5 J S Heyne , A L Boehman , S Kirby . Autoignition studies of trans- and cis-decalin in an ignition quality tester (IQT) and the development of a high thermal stability unifuel/single battlefield fuel. Energy & Fuels, 2009, 23(12): 5879–5885
https://doi.org/10.1021/ef900715m
6 T M Lovestead , T J Bruno . A comparison of the hypersonic vehicle fuel JP-7 to the rocket propellants RP-1 and RP-2 with the advanced distillation curve method. Energy & Fuels, 2009, 23(7): 3637–3644
https://doi.org/10.1021/ef900096q
7 D Sun , C Li , Y Du , L Kou , J Zhang , Y Li , Z Wang , J Li , H Feng , J Lu . Effects of endothermic hydrocarbon fuel composition on the pyrolysis and anti-coking performance under supercritical conditions. Fuel, 2019, 239: 659–666
https://doi.org/10.1016/j.fuel.2018.11.003
8 L Yue , G Li , G He , Y Guo , L Xu , W Fang . Impacts of hydrogen to carbon ratio (H/C) on fundamental properties and supercritical cracking performance of hydrocarbon fuels. Chemical Engineering Journal, 2016, 283: 1216–1223
https://doi.org/10.1016/j.cej.2015.08.081
9 H B Mostad , T U Riis , O H Ellestad . Catalytic cracking of naphthenes and naphtheno-aromatics in fixed bed micro reactors. Applied Catalysis, 1990, 63(1): 345–364
https://doi.org/10.1016/S0166-9834(00)81724-8
10 W Hillebrand , W Hodek , G Kölling . Steam cracking of coal-derived oils and model compounds: 1. Cracking of tetralin and t-decalin. Fuel, 1984, 63(6): 756–761
https://doi.org/10.1016/0016-2361(84)90063-2
11 Z ZhouZ MiX ZhangD Fei. Study on pyrolysis of endothermic propellant decalin in supercritical state. In: International Autumn Seminar on Propellants. Guilin(CN): Explosives & Pyrotecnics (2003 IASPEP), 2003, 1015–1018
12 J Yu , S Eser . Thermal decomposition of jet fuel model compounds under near-critical and supercritical conditions. 2. Decalin and tetralin. Industrial & Engineering Chemistry Research, 1998, 37(12): 4601–4608
https://doi.org/10.1021/ie980302y
13 M Santikunaporn , J E Herrera , S Jongpatiwut , D E Resasco , W E Alvarez , E L Sughrue . Ring opening of decalin and tetralin on HY and Pt/HY zeolite catalysts. Journal of Catalysis, 2004, 228(1): 100–113
https://doi.org/10.1016/j.jcat.2004.08.030
14 E F Sousa-Aguiar , C J A Mota , M M L Valle , M P Silva , D F Silva . Catalytic cracking of decalin isomers over REHY-zeolites with different crystallite sizes. Journal of Molecular Catalysis A Chemical, 1996, 104(3): 267–271
https://doi.org/10.1016/1381-1169(95)00149-2
15 T Jia , L Pan , X Wang , J Xie , S Gong , Y Fang , H Liu , X Zhang , J J Zou . Mechanistic insights into the thermal oxidative deposition of C10 hydrocarbon fuels. Fuel, 2021, 285: 119–136
https://doi.org/10.1016/j.fuel.2020.119136
16 H Chi , G Li , Y Guo , L Xu , W Fang . Excess molar volume along with viscosity, flash point, and refractive index for binary mixtures of cis-decalin or trans-decalin with C9 to C11 n-alkanes. Journal of Chemical & Engineering Data, 2013, 58(8): 2224–2232
https://doi.org/10.1021/je400250u
17 X Wang , T Jia , L Pan , Q Liu , Y Fang , J J Zou , X Zhang . Review on the relationship between liquid aerospace fuel composition and their physicochemical properties. Transactions of Tianjin University, 2021, 27(2): 87–109
https://doi.org/10.1007/s12209-020-00273-5
18 Q Liu , L Pan , T Jia , X Zhang , J J Zou . Alkyl-adamantane as high-density endothermic fuel: synthesis and thermal cracking performance. Fuel, 2022, 324: 124688
https://doi.org/10.1016/j.fuel.2022.124688
19 L Yue , X Qin , X Wu , Y Guo , L Xu , H Xie , W Fang . Thermal decomposition kinetics and mechanism of 1,1′-bicyclohexyl. Energy & Fuels, 2014, 28(7): 4523–4531
https://doi.org/10.1021/ef501077n
20 W SunS LiY Liu. Research & development of decalin catalytic cracking. Petroleum Refinery Engineering, 2015, 45: 1-5 (in Chinese)
21 J Yu , S Eser . Supercritical-phase thermal decomposition of binary mixtures of jet fuel model compounds. Fuel, 2000, 79(7): 759–768
https://doi.org/10.1016/S0016-2361(99)00199-4
22 H Li , Y Wang , L Wang , X Zhang , G Liu . Pyrolysis and coke deposition of JP-10 with decalin in regenerative cooling channels. Energy & Fuels, 2022, 36(12): 6096–6108
https://doi.org/10.1021/acs.energyfuels.2c00498
23 Y XingQ WangW Fang. The analysis of decalin pyrolysis property under supercritical conditions. Journal of Zhejiang University Science Edition, 2014, 41(2): 161–167 (in Chinese)
24 J M Andresen , J J Strohm , L Sun , C Song . Relationship between the formation of aromatic compounds and solid deposition during thermal degradation of jet fuels in the pyrolytic regime. Energy & Fuels, 2001, 15(3): 714–723
https://doi.org/10.1021/ef000256q
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