CAS: 95418-58-9; 4-Tert-Butoxystyrene

• 英文名称4-Tert-Butoxystyrene
• 中文名称4-叔丁氧基苯乙烯
• IUPAC名称1-(tert-butoxy)-4-vinylbenzene
• 其它别名4- 叔 -丁氧基苯乙烯; Tert-Butyl 4-Ethenylphenyl Ether
• CAS编号95418-58-9
• MFCD编号:MFCD00145183
• EINECS号:619-127-3
• 分子式:C12H16O
• 分子量:176.26
• 产品CID: 2007216
• 产品分类有机原料→材料科学→高分子材料→高分子单体

• 相似结构搜索
• InChIKey: GRFNSWBVXHLTCI-UHFFFAOYSA-N
• InChI=1S/C12H16O/c1-5-10-6-8-11(9-7-10)13-12(2,3)4/h5-9H,1H2,2-4H3…
• 计算化学: 氢键受体数1.0氢键供体数0可旋转键数2

相似化合物

物理性质

• 熔点-38 °C
• 沸点256.8±9.0 °C Press: 760 Torr
• 闪点207 °F
• 密度0.936 g/mL at 25 °C(文献)
• PSA:9.23
• LogP:3.5069
• 折射率n 20/D 1.524(文献)
• 蒸汽压17.999Pa at 20°C
• 外观形态无色至几乎无色澄清液体
• 储存条件2-8°C
• 产品应用该化合物用于合成4'-之三-丁氧-联苯-4-盒状酸甲基酯.
• 性质描述密度0.936,熔点-38°C,沸点72-73°C(0.1毫米汞柱),折射率1.524,闪点207°F

MSDS等安全信息

• GHS象形图
• GHS符号GHS07 & GHS09;
  注释: Exclamation mark & Environment
• 危险类别皮肤腐蚀/刺激 类别2
  皮肤致敏 类别1
  水生慢性毒性 类别2
  特定目标器官毒性 - 单次接触 类别3
  严重眼刺激 类别2
  急性毒性 类别4(经口)
  严重眼刺激 类别2A
• 警示词Warning(警告)
• 危险描述H315 |造成皮肤刺激.
  H317 |可能引起皮肤过敏反应.
  H411 |对水生生物有毒并具有长期持续影响.
  H335 |可能引起呼吸道刺激.
  H319 |造成严重眼刺激.
  H302 |吞咽有害.
• 防范说明P261-P264-P271-P280-P302+P352-P304+P340-P362+P364-P405-P501
• 危险品标志Xi
• 安全声明26-36
• 危险类别码36/37/38
• WGK Germany3

欧盟法规

上下游产品

合成工艺路线路线简述

• 104333-10-0 = 95418-58-9
  反应条件:1.1 Reagents: Potassium Bisulfate Catalysts: Tempo; Rt -> 130 °C; 100 Mm Hg,130 °C; 130 °C -> 180 °C; 180 °C; 30 Min,180 °C; 180 °C -> 190 °C
  标题:Novel Process For Producing Styrene Compound
  参考文献:China]
  
  60876-70-2 = 95418-58-9
  反应条件:1.1 Reagents: Triethylamine Catalysts: Palladium Diacetate,Tri-O-Tolylphosphine Solvents: Acetonitrile
  标题:Improved Preparation Of 4-Tert-Butoxystyrene
  参考文献:Japan]
  
  104333-10-0 = 95418-58-9
  反应条件:1.1 Reagents: Sodium Bicarbonate Catalysts: Triphenylphosphine,Aluminum Chloride Solvents: Nitromethane; 2 H,Rt -> 80 °C
  标题:Preparation Of Phenenyl Compound
  参考文献:China]
  
  3536-96-7 + 60876-70-2 = 95418-58-9
  反应条件:1.1 Catalysts: [1,1′-Bis(Diphenylphosphino)Ferrocene]Dichloropalladium Solvents: Tetrahydrofuran; 3 H,0 °C; 0 °C -> 5 °C1.2 Reagents: Hydrochloric Acid Solvents: Water; 0.5 H,10 °C
  标题:Preparation Of 4-Tert-Butoxystyrene
  参考文献:China]
  
  329318-60-7 = 95418-58-9
  反应条件:1.1 Reagents: Potassium Carbonate Catalysts: Molybdate(42-),Triacontakis[μ-(Acetato-Ko:Ko′)]Doheptacontaaquaoctacontahecta-μ... Solvents: Dimethyl Sulfoxide; 36 H
  标题:Light Driven Decarboxylative Cross Coupling Of Acrylic Acid And Iodobenzene Using [mo132] Type Keplerate As Catalyst
  作者:Das,Santu; Misra,Archismita; Roy,Soumyajit
  参考文献:Inorganica Chimica Acta 日期:2017 卷标:460 页码:77-82]
  
  51503-08-3 + 67-71-0 = 95418-58-9
  反应条件:1.1 Reagents: Potassium Tert-Butoxide Catalysts: 1,10-Phenanthroline,Ferrous Chloride Solvents: Toluene; 8 H,120 °C
  标题:Iron-Catalyzed Direct Julia-Type Olefination Of Alcohols
  作者:Landge,Vinod G.; Babu,Reshma; Yadav,Vinita; Subaramanian,Murugan; Gupta,Virendrakumar; Et Al
  参考文献:Journal Of Organic Chemistry 日期:2020 卷标:85(15) 页码:9876-9886]
  
  677-22-5 = 95418-58-9
  反应条件:1.1 Catalysts: Sec-Butyllithium Solvents: Tetrahydrofuran; -78 °C
  标题:Analysis Of Homopolymer Distribution In A Polymer Blend Thin Film By Anomalous Grazing Incidence Small-Angle X-Ray Scattering At The Bromine K-Edge
  作者:Hamamoto,Hiroki; Takagi,Hideaki; Akiba,Isamu; Yamamoto,Katsuhiro
  参考文献:Macromolecules (Washington 日期:2021 卷标:54(1) 页码:488-498]
  
  1073-67-2 = 95418-58-9 [标题:Reaction Conditions
  标题:Photoresist Compositions Containing Substituted Organomethyl Vinylaryl Ether Materials
  参考文献:United States]
  
  = 95418-58-9 [标题:Reaction Conditions
  标题:Distillation Of Oxystyrenes
  参考文献:Japan]
  
  1104636-73-8 + 18995-35-2 = 95418-58-9
  反应条件:1.1 Reagents: Tripotassium Phosphate Catalysts: Palladium Diacetate,2-Dicyclohexylphosphino-2′,6′-Dimethoxybiphenyl Solvents: 1,4-Dioxane,Water; 6 H,100 °C
  标题:N-(Carboxymethyl)-N-Methyl-Glycine
  作者:Dailey,Ian; Burke,Martin D.
  参考文献:E-Eros Encyclopedia Of Reagents For Organic Synthesis 日期:2010 卷标:1 页码:1-7]
  
  1104636-73-8 + 18995-35-2 = 95418-58-9
  反应条件:1.1 Reagents: Tripotassium Phosphate Catalysts: Palladium Diacetate,2-Dicyclohexylphosphino-2′,6′-Dimethoxybiphenyl Solvents: 1,4-Dioxane,Water; 6 H,60 °C
  标题:Slow Release Of Organoboronic Acids In Cross-Coupling Reactions
  参考文献:World Intellectual Property Organization]
  
  1104636-73-8 + 18995-35-2 = 95418-58-9
  反应条件:1.1 Catalysts: Palladium Diacetate,2-Dicyclohexylphosphino-2′,6′-Dimethoxybiphenyl Solvents: 1,4-Dioxane,Water; 23 °C; 10 Min,23 °C1.2 Reagents: Tripotassium Phosphate Solvents: Water; 23 °C; 6 H,60 °C
  标题:A General Solution For Unstable Boronic Acids: Slow-Release Cross-Coupling From Air-Stable Mida Boronates
  作者:Knapp,David M.; Gillis,Eric P.; Burke,Martin D.
  参考文献:Journal Of The American Chemical Society 日期:2009 卷标:131(20) 页码:6961-6963]
  
  60876-70-2 = 95418-58-9
  反应条件:1.1 Reagents: Magnesium Catalysts: Iodine Solvents: Tetrahydrofuran; 1 H,40 - 50 °C1.2 Catalysts: Ferrous Bromide; 1 H,20 - 30 °C
  标题:Process For The Production Of Styrene Compound,And Styrene Compound Free From Biphenyl
  参考文献:United States]
  
  1225375-38-1 = 95418-58-9
  反应条件:1.1 Reagents: 2-Methyl-2-Butanol,Potassium Phosphate Catalysts: 1,4-Bis(Diphenylphosphino)Butane,Di-μ-Chlorobis[(1,2,5,6-η)-1,5-Cyclooctadiene]Dirhodium Solvents: Toluene; Rt -> 100 °C; 2 H,100 °C
  标题:Preparation Of Vinyl Compounds Using Vinyl Acetates As Vinylation Agents
  参考文献:Japan]
  
  18995-35-2 = 95418-58-9
  反应条件:1.1 Reagents: Ethyl Bromide,Magnesium Solvents: Tetrahydrofuran1.2 Catalysts: Manganese Dichloride Solvents: Tetrahydrofuran
  标题:Preparation Of Biphenyl-Free Tert-Butoxystyrene
  参考文献:Japan]
  
  51503-08-3 + 67-71-0 = 95418-58-9
  反应条件:1.1 Reagents: Potassium Tert-Butoxide Catalysts: (Oc-6-44)-Aquadichloro[4,4′-[(2,6-Pyridinediyl-Kn)Bis(Methylene)]Bis[morpholine-... Solvents: Toluene; 12 H,110 °C
  标题:Nickel(Ii)-Catalyzed Direct Olefination Of Benzyl Alcohols With Sulfones With The Liberation Of H2
  作者:Landge,Vinod G.; Yadav,Vinita; Subaramanian,Murugan; Dangarh,Pragya; Balaraman,Ekambaram
  参考文献:Chemical Communications (Cambridge 日期:2019 卷标:55(43) 页码:6130-6133]
  
  1104636-73-8 + 18995-35-2 = 95418-58-9
  反应条件:1.1 Reagents: Tripotassium Phosphate Catalysts: Palladium Diacetate,2-Dicyclohexylphosphino-2′,6′-Dimethoxybiphenyl Solvents: 1,4-Dioxane,Water; 6 H,100 °C
  标题:N-(Carboxymethyl)-N-Methyl-Glycine
  作者:Dailey,Ian; Burke,Martin D.
  参考文献:E-Eros Encyclopedia Of Reagents For Organic Synthesis 日期:2007]
  
  = 95418-58-9 [标题:Reaction Conditions
  标题:Site-Selective Alkoxylation Of Benzylic C-H Bonds By Photoredox Catalysis
  作者:Lee,Byung Joo; Deglopper,Kimberly S.; Yoon,Tehshik P.
  参考文献:Angewandte Chemie 日期:2020 卷标:59(1) 页码:197-202]
  
  = 95418-58-9 [标题:Reaction Conditions
  标题:Distillation Of Styrenes
  参考文献:Japan]
  
  = 95418-58-9 [标题:Reaction Conditions
  标题:Preparation Of P-Tert-Butoxystyrene As Intermediate For Drugs,Agrochemicals,And Monomers
  参考文献:Japan

海关参考信息

• 2901210000-乙烯
  2902300000-甲苯
  2902500000-苯乙烯
  2905122000-异丙醇
• 💡 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

专利信息

其他信息查阅

• ➥ 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