CAS: 873-66-5; Trans-ß-Methylstyrene

• 英文名称Trans-ß-Methylstyrene
• 中文名称(E)-丙-1-烯-1-基苯
• IUPAC名称(E)-prop-1-en-1-ylbenzene
• 其它别名(E)-1-丙烯基苯; Trans-Propenylbenzene (Stabilized With Tbc)
• CAS编号873-66-5
• MFCD编号:MFCD00009280
• EINECS号:212-848-0
• 分子式:C9H10分子量:118.18
• 产品CID: 1880104
• 产品分类有机原料→分子砌块→芳环类化合物→苯类化合物

• 相似结构搜索
• InChIKey: QROGIFZRVHSFLM-QHHAFSJGSA-N
• InChI=1S/C9H10/c1-2-6-9-7-4-3-5-8-9/h2-8H,1H3/b6-2+
• 计算化学: 氢键受体数*氢键供体数0可旋转键数1

物理性质

• 熔点-29 °C
• 沸点175 °C at 760 mmHg
• 闪点60.0±0.0 °C
• 密度0.9±0.1 g/cm3
• LogP:3.3558
• 折射率1.560
• 蒸汽压2.2±0.1 mmHg at 25°C
• 溶解性可溶于氯仿,甲醇(少许)
• 敏感性1. 常温常压下稳定，避免氧化物接触2. 存在于烟气中。
• 外观形态液体;Colorless to Light yellow clear liquid
• 储存条件2-8°C
• 产品应用该化合物用于逐步转移剂.

MSDS等安全信息

• GHS象形图
• GHS符号GHS02 & GHS08 & GHS07 & GHS05;
  注释: Flame & Health hazard & Exclamation mark & Corrosion
• 危险类别易燃液体 类别3
  吸入危害 类别1
  特定目标器官毒性 - 单次接触 类别3
  皮肤腐蚀/刺激 类别2
  严重眼损伤 类别1
  呼吸道致敏 类别1
  急性毒性 类别4(吸入)
  严重眼刺激 类别2
  水生慢性毒性 类别2
• 警示词Danger(危险)
• 危险描述H226 |易燃液体和蒸气.
  H304 |吞咽并进入呼吸道可能致命.
  H335 |可能引起呼吸道刺激.
  H315 |造成皮肤刺激.
  H318 |造成严重眼损伤.
  H334 |吸入可能引起过敏或哮喘症状或呼吸困难.
  H332 |吸入有害.
  H319 |造成严重眼刺激.
  H411 |对水生生物有毒并具有长期持续影响.
• 防范说明P210-P233-P240-P241-P242-P243-P261-P264-P271-P273-P280-P284-P302+P352-P304+P340-P331-P362+P364-P370+P378-P391-P405-P501
• 危险等级3
• UN编号2618.0
• 危险品标志Xn: Harmful;N: Dangerous for the environment;
• 包装等级Ⅲ
• 安全声明S16-S26-S36/37/39-S61-S62
• 危险类别码R36/37/38
• WGK Germany2

欧盟法规

上下游产品

合成工艺路线路线简述

• 766-90-5 = 873-66-5
  反应条件:1.1 Reagents: Hydrogen Catalysts: Copper Nitride (Cu3N),Palladium Solvents: Ethanol; 100 Min,0.1 Mpa,80 °C
  标题:Atomically Dispersed Palladium Catalyzes H/d Exchange And Isomerization Of Alkenes Via Reversible Insertion And Elimination
  作者:Liu,Kunlong; Qin,Ruixuan; Li,Kaijia; Zhang,Weijie; Ruan,Pengpeng; Et Al
  参考文献:Chem Catalysis 日期:2021 卷标:1(7) 页码:1480-1492]
  
  300-57-2 = 873-66-5
  反应条件:1.1 Reagents: (Ethenyloxy)Trimethylsilane Catalysts: Grubbs Second Generation Catalyst Solvents: Dichloromethane; 1.5 H,Reflux
  标题:Development Of Isomerization And Cycloisomerization With Use Of A Ruthenium Hydride With N-Heterocyclic Carbene And Its Application To The Synthesis Of Heterocycles
  作者:Arisawa,Mitsuhiro; Terada,Yukiyoshi; Takahashi,Kazuyuki; Nakagawa,Masako; Nishida,Atsushi
  参考文献:Journal Of Organic Chemistry 日期:2006 卷标:71(11) 页码:4255-4261]
  
  300-57-2 = 873-66-5
  反应条件:1.1 Reagents: (Ethenyloxy)Trimethylsilane Catalysts: (Sp-5-41)-Dichloro[1,3-Dihydro-1,3-Bis(2,4,6-Trimethylphenyl)-2H-Imidazol-2-Ylid... Solvents: Dichloromethane; 1.5 H,50 °C
  标题:Selective Isomerization Of A Terminal Olefin Catalyzed By A Ruthenium Complex: The Synthesis Of Indoles Through Ring-Closing Metathesis
  作者:Arisawa,Mitsuhiro; Terada,Yukiyoshi; Nakagawa,Masako; Nishida,Atsushi
  参考文献:Angewandte Chemie 日期:2002 卷标:41(24) 页码:4732-4734]
  
  300-57-2 = 873-66-5
  反应条件:1.1 Catalysts: (Oc-6-21)-Dimethylbis[4-Methyl-N,N′-Bis(Trimethylsilyl)Benzenecarboximidamidato-... Solvents: Toluene
  标题:Catalytic Isomerization And Disproportionation Of Olefins Promoted By Group 4/d0 Benzamidinate Complexes
  作者:Averbuj,Claudia; Eisen,Moris S.
  参考文献:Journal Of The American Chemical Society 日期:1999 卷标:121(38) 页码:8755-8759]
  
  23355-97-7 = 873-66-5
  反应条件:1.1 Reagents: Isopropanol Catalysts: Silver,Hydrotalcite (Mg6(Co3)[al(Oh)6]2(Oh)4.4H2O) Solvents: Toluene; 8 H,110 °C
  标题:Supported Gold And Silver Nanoparticles For Catalytic Deoxygenation Of Epoxides Into Alkenes
  作者:Mitsudome,Takato; Noujima,Akifumi; Mikami,Yusuke; Mizugaki,Tomoo; Jitsukawa,Koichiro; Et Al
  参考文献:Angewandte Chemie 日期:2010 卷标:49(32) 页码:5545-5548]
  
  23355-97-7 = 873-66-5
  反应条件:1.1 Reagents: Isopropanol Catalysts: Gold,Mg Al Hydrotalcite Solvents: Toluene; 4 H,110 °C
  标题:Gold Nanoparticle-Catalyzed Environmentally Benign Deoxygenation Of Epoxides To Alkenes
  作者:Noujima,Akifumi; Mitsudome,Takato; Mizugaki,Tomoo; Jitsukawa,Koichiro; Kaneda,Kiyotomi
  参考文献:Molecules 日期:2011 卷标:16 页码:8209-8227]
  
  300-57-2 = 873-66-5
  反应条件:1.1 Reagents: Oxygen,Aluminum Triflate Catalysts: Palladium Diacetate Solvents: Acetonitrile; 2 H,30 °C
  标题:Nonredox Metal-Ion-Accelerated Olefin Isomerization By Palladium(Ii) Catalysts: Density Functional Theory (Dft) Calculations Supporting The Experimental Data
  作者:Senan,Ahmed M.; Qin,Shuhao; Zhang,Sicheng; Lou,Chenling; Chen,Zhuqi; Et Al
  参考文献:Acs Catalysis 日期:2016 卷标:6(7) 页码:4144-4148]
  
  1821-12-1 = 873-66-5
  反应条件:1.1 Reagents: Acetic Anhydride,Triethylamine Catalysts: Palladium Chloride,Bis[2-(Diphenylphosphino)Phenyl] Ether Solvents: Acetonitrile; 18 H,Reflux
  标题:Selective Preparation Of Terminal Alkenes From Aliphatic Carboxylic Acids By A Palladium-Catalysed Decarbonylation-Elimination Reaction
  作者:Le Notre,Jerome; Scott,Elinor L.; Franssen,Maurice C. R.; Sanders,Johan P. M.
  参考文献:Tetrahedron Letters 日期:2010 卷标:51(29) 页码:3712-3715]
  
  300-57-2 = 873-66-5
  反应条件:1.1 Catalysts: 2757685-54-2 Solvents: Acetone-D6; 24 H,50 °C
  标题:New Access Routes To Privileged And Chiral Ligands For Transition-Metal Catalyzed Hydrogen Autotransfer (Borrowing Hydrogen),Dehydrogenative Condensation,And Alkene Isomerization Reactions
  作者:Koller,Sebastian; Klein,Philippe; Reinhardt,Katja; Ochmann,Lukas; Seitz,Antonia; Et Al
  参考文献:Helvetica Chimica Acta 日期:2021 卷标:104(12)]
  
  300-57-2 = 873-66-5
  反应条件:1.1 Reagents: Phenylmagnesium Bromide Catalysts: Iron(Iii) Acetylacetonate Solvents: Tetrahydrofuran; 2 H,25 °C1.2 Reagents: Sodium Bicarbonate Solvents: Water
  标题:Iron-Catalyzed Isomerizations Of Olefins
  作者:Mayer,Matthias; Welther,Alice; Von Wangelin,Axel Jacobi
  参考文献:Chemcatchem 日期:2011 卷标:3(10) 页码:1567-1571]
  
  673-32-5 = 873-66-5
  反应条件:1.1 Reagents: Ammonia Borane Catalysts: Nickel,Bis[1,1′-(1,2-Ethanediyl)Bis[1,1-Bis(1-Methylethyl)Phosphine-Kp]]Di-μ-Hy... Solvents: Methanol; Rt; 72 H,80 °C
  标题:Semihydrogenation Of Alkynes In The Presence Of Ni(0) Catalyst Using Ammonia-Borane And Sodium Borohydride As Hydrogen Sources
  作者:Barrios-Francisco,Rigoberto; Garcia,Juventino J.
  参考文献:Applied Catalysis 日期:2010 卷标:385(1-2) 页码:108-113]
  
  93-54-9 = 873-66-5
  反应条件:1.1 Catalysts: Rhenium Oxide (Re2O7) Solvents: Toluene; 24 H,100 °C
  标题:Catalytic Dehydration Of Benzylic Alcohols To Styrenes By Rhenium Complexes
  作者:Korstanje,Ties J.; Jastrzebski,Johann T. B. H.; Klein Gebbink,Robertus J. M.
  参考文献:Chemsuschem 日期:2010 卷标:3(6) 页码:695-697]
  
  21040-45-9 = 873-66-5
  反应条件:1.1 Reagents: Tributylstannane Catalysts: Tetrakis(Triphenylphosphine)Palladium Solvents: Tetrahydrofuran
  标题:The Stille Reaction
  作者:Farina,Vittorio; Krishnamurthy,Venkat; Scott,William J.
  参考文献:Organic Reactions (Hoboken 日期:1997 卷标:50]
  
  300-57-2 = 873-66-5
  反应条件:1.1 Catalysts: Anthracene (Magnesium Cluster Salts); 5 - 100 Min,300 °C
  标题:Catalytic Isomerization Of Allylbenzene On Organomagnesium Clusters
  作者:Potapov,D. A.; Tjurina,L. A.; Smirnov,V. V.
  参考文献:Russian Chemical Bulletin 日期:2005 卷标:54(5) 页码:1185-1188]
  
  = 873-66-5
  反应条件:1.1 Solvents: Benzene-D6
  标题:Synthesis,Structure,And Thermolysis Of A Tetracoordinate 1,2-Oxaboretanide: An Intermediate Of The Boron-Wittig Reaction Under Basic Conditions
  作者:Kawashima,Takayuki; Yamashita,Naoko; Okazaki,Renji
  参考文献:Journal Of The American Chemical Society 日期:1995 卷标:117(22) 页码:6142-3]
  
  673-32-5 = 873-66-5
  反应条件:1.1 Reagents: Lithium Aluminum Hydride Solvents: Tetrahydrofuran; 13 H,66 °C1.2 Reagents: Water
  标题:Syntheses Using Alkyne-Derived Alkenyl- And Alkynylaluminum Compounds
  作者:Zweifel,George; Miller,Joseph A.
  参考文献:Organic Reactions (Hoboken 日期:1984 卷标:32]
  
  300-57-2 = 873-66-5
  反应条件:1.1 Catalysts: (Oc-6-12)-Hydro[[n,N′-(1H-Isoindole-1,3(2H)-Diyl-Kn)Bis[6-Methyl-2-Pyridinaminat... Solvents: Acetonitrile; 3 H,Rt
  标题:Catalytic Olefin Transpositions Facilitated By Ruthenium N,N,N-Pincer Complexes
  作者:Davies,Alex M.; Greene,Kara H.; Allen,Anthony R.; Stephenson,Corey R. J.; Szymczak,Nathaniel K.
  参考文献:Chemrxiv 日期:2022 卷标:1 页码:1-8]
  
  300-57-2 = 873-66-5
  反应条件:1.1 Reagents: Aluminum Chloride Catalysts: Bis(1,5-Cyclooctadiene)Nickel,1-(2,4,6-Trimethylphenyl)-1H-Imidazole; 30 Min,130 °C
  标题:Nickel-Catalyzed Para-Ch Activation Of Pyridine With Switchable Regioselective Hydroheteroarylation Of Allylarenes
  作者:Lee,Wei-Chih; Chen,Chien-Hung; Liu,Cheng-Yuan; Yu,Ming-Shiuan; Lin,Yung-Huei; Et Al
  参考文献:Chemical Communications (Cambridge 日期:2015 卷标:51(96) 页码:17104-17107]
  
  588-72-7 = 873-66-5
  反应条件:1.1 Catalysts: Tetrakis(Triphenylphosphine)Palladium Solvents: Benzene
  标题:Palladium-Catalyzed Methylation Of Aryl And Vinyl Halides By Stabilized Methylaluminum And Methylgallium Complexes
  作者:Blum,Jochanan; Gelman,Dmitri; Baidossi,Waeel; Shakh,Eduard; Rosenfeld,Ayelet; Et Al
  参考文献:Journal Of Organic Chemistry 日期:1997 卷标:62(25) 页码:8681-8686

海关参考信息

• 2901210000-乙烯
  2901220000-丙烯
  2902300000-甲苯
  2902500000-苯乙烯
• 💡 提示：海关信息按照顺序优先匹配，如需确认的海关信息，请参考相关资料。
• 详情请参考：📖 海关编码查询和海关进出口税则

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• ➥ 象形图和危险代码
• ➥ 防范代码详解
• ➥ 危险代码说明
• ➥ Globally Harmonized System
• ➥ REACH监管