CAS: 92-91-1; 1-([1,1'-Biphenyl]-4-yl)Ethanone

• 英文名称1-([1,1'-Biphenyl]-4-yl)Ethanone
• 中文名称联苯单乙酮
• IUPAC名称1-([1,1'-biphenyl]-4-yl)ethan-1-one
• 其它别名4-乙酰联苯
• CAS编号92-91-1
• MFCD编号:MFCD00008749
• EINECS号:202-202-6
• FDA UNII编号:PX5XEZ9DQD
• 分子式:C14H12O
• 分子量:196.24
• 产品CID: 1967990
• 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
• 产品信息参考;;
• InChIKey: QCZZSANNLWPGEA-UHFFFAOYSA-N
• InChI=1S/C14H12O/c1-11(15)12-7-9-14(10-8-12)13-5-3-2-4-6-13/h2-10H,1H3…
• 计算化学: 氢键受体数1.0氢键供体数0.0可旋转键数2.0

物理性质

• 熔点117-123°C
• 沸点325-327°C at 760 mmHg
• 闪点139.9±14.2 °C
• 密度1.1±0.1 g/cm3
• PSA:17.07
• LogP:3.5562
• 折射率1.567
• 蒸汽压0.0±0.7 mmHg at 25°C
• 溶解性Chloroform: Soluble10Mg/200Microlitres, Clear, Colorless To Faintly Yellow
• 外观形态白色至绿色至棕色固体
• 储存条件2-8°C
• 产品应用抗炎剂联苯乙酸的中间体.
• 性质描述白色固体结晶.熔点116-118°C,沸点325-327°C.

MSDS等安全信息

• GHS象形图
• GHS符号GHS07;
  注释: Exclamation mark
• 危险类别特定目标器官毒性 - 单次接触 类别3
  皮肤腐蚀/刺激 类别2
  严重眼刺激 类别2A
  严重眼刺激 类别2
• 警示词Warning(警告)
• 危险描述H335 |可能引起呼吸道刺激.
  H315 |造成皮肤刺激.
  H319 |造成严重眼刺激.
• 防范说明P264-P280-P302+P352-P362
• UN编号NONH for all modes of transport
• 危险品标志Xi
• 安全声明22-24/25-36-26
• 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

• 合成目标产物 4-Acetylbiphenyl 主要起始原料 4'-Hydroxyacetophenone And Phenylboronic Acid
• 13329-40-3 + 639-58-7 = 92-91-1
  反应条件:1.1 Reagents: Tetrabutylammonium Fluoride Catalysts: Tris(Dibenzylideneacetone)Dipalladium Solvents: Toluene,Tetrahydrofuran; Rt; 2 H,100 °C
  标题:Fluoride-Promoted Cross-Coupling Of Chloro(Mono-,Di-,Or Triphenyl)Germanes With Aryl Halides In "Moist" Toluene. Multiple Transfer Of The Phenyl Group From Organogermane Substrates And Comparison Of The Coupling Efficiencies Of Chloro(Phenyl)Germanes With Their Corresponding Stannane And Silane Counterparts
  作者:Pitteloud,Jean-Philippe; Zhang,Zun-Ting; Liang,Yong; Cabrera,Laura; Wnuk,Stanislaw F.
  参考文献:Journal Of Organic Chemistry 日期:2010 卷标:75(23) 页码:8199-8212]
  
  98-80-6 + 99-90-1 = 92-91-1
  反应条件:1.1 Reagents: Potassium Carbonate Catalysts: Palladium Diacetate Solvents: Dimethylformamide,Water; 1 H,110 °C
  标题:Recoverable Palladium Catalysts For Suzuki-Miyaura Cross-Coupling Reactions Based On Organic-Inorganic Hybrid Silica Materials Containing Imidazolium And Dihydroimidazolium Salts
  作者:Trilla,Montserrat; Borja,Guadalupe; Pleixats,Roser; Man,Michel Wong Chi; Bied,Catherine; Et Al
  参考文献:Advanced Synthesis & Catalysis 日期:2008 卷标:350(16) 页码:2566-2574]
  
  55660-68-9 + 56296-15-2 = 92-91-1
  反应条件:1.1 Reagents: Cesium Carbonate Catalysts: Palladium Diacetate,Bis(1,1-Dimethylethyl)[2′,4′,6′-Tris(1-Methylethyl)[1,1′-Biphenyl]-2-Yl]Phosphin... Solvents: Toluene,Water; 80 °C
  标题:Suzuki-Miyaura Coupling Of Aryl Nosylates With Diethanolamine Boronates
  作者:Kohler,Philipp; Perrin,Timothe; Schafer,Gabriel
  参考文献:Synthesis 日期:2023 卷标:55(19) 页码:3159-3171]
  
  98-80-6 + 13329-40-3 = 92-91-1
  反应条件:1.1 Reagents: Potassium Carbonate Catalysts: (Sp-4-3)-Chloro[2-(Diphenylphosphino-Kp)-N-[2-(Diphenylphosphino-Kp)Phenyl]Benze... Solvents: 1-Butanol,Water; 12 H,100 °C
  标题:Aqueous Suzuki Couplings Mediated By A Hydrophobic Catalyst
  作者:Hong,Sheng-Bo; Liang,Lan-Chang
  参考文献:Rsc Advances 日期:2022 卷标:12(44) 页码:28862-28866]
  
  98-80-6 + 99-90-1 = 92-91-1
  反应条件:1.1 Reagents: Potassium Carbonate,Oxygen Catalysts: 2842071-34-3 Solvents: Ethanol,Water; 6 H,80 °C
  标题:Palladium Complexes Of Pnnp Type Diiminodiphosphine Ligands For The Suzuki C-C Coupling Reactions
  作者:Tezcan,Burcu; Kemal Yilmaz,Mustafa; Yakali,Gul; Aygun,Muhittin; Guzel,Bilgehan
  参考文献:Inorganica Chimica Acta 日期:2022 卷标:543]
  
  3562-73-0 = 92-91-1
  反应条件:1.1 Reagents: Tetrabutylammonium Tetrafluoroborate Solvents: Acetonitrile,Water; 4.5 H,Rt
  标题:An Efficient Electrochemical Oxidation Of C(Sp3)-H Bond For The Synthesis Of Arylketones
  作者:Kong,Jingyang; Zhang,Feng; Zhang,Chenxuan; Chang,Weixing; Liu,Lingyan; Et Al
  参考文献:Molecular Catalysis 日期:2022 卷标:530]
  
  98-80-6 + 99-90-1 = 92-91-1
  反应条件:1.1 Reagents: Tripotassium Phosphate Catalysts: 2820068-26-4 Solvents: Chloroform,Toluene; 2 H,80 °C
  标题:Pd(Ii) Complexes With Pyridine Ligands: Substituent Effects On The Nmr Data,Crystal Structures,And Catalytic Activity
  作者:Kurpik,Gracjan; Walczak,Anna; Goldyn,Mateusz; Harrowfield,Jack; Stefankiewicz,Artur R.
  参考文献:Inorganic Chemistry 日期:2022 卷标:61(35) 页码:14019-14029]
  
  98-80-6 + 13329-40-3 = 92-91-1
  反应条件:1.1 Reagents: Potassium Carbonate Catalysts: Palladium Diacetate,Poly[oxy[(Chloromethyl)-1,2-Ethanediyl]] (Reaction Products With Methylimidazole And Bis(Trifluoromethylsulfonyl)Imide Ion-Exchanged) Solvents: Water; 30 Min,60 °C
  标题:From A Single Helix To A Helical Porous Metalloenzyme Catalyst Based On Temperature Sensitive Polyionic Liquids
  作者:Li,Xinjuan; Zhou,Zhangquan; Dong,Jiaxin; Sun,Yanping; Ma,Guanglei; Et Al
  参考文献:Polymer Chemistry 日期:2022 卷标:13(33) 页码:4789-4797]
  
  98-80-6 + 99-90-1 = 92-91-1
  反应条件:1.1 Reagents: Potassium Hydroxide Catalysts: 1902962-58-6 Solvents: Toluene; 15 Min,Rt -> 100 °C
  标题:Tandem Suzuki-Miyaura/transfer Hydrogenation Reaction Catalyzed By A Pd-Ru Complex Bearing An Anionic Dicarbene
  作者:Bitzer,Mario J.; Kuehn,Fritz E.; Baratta,Walter
  参考文献:Journal Of Catalysis 日期:2016 卷标:338 页码:222-226]
  
  98-80-6 + 99-90-1 = 92-91-1
  反应条件:1.1 Reagents: Sodium Hydroxide Catalysts: 2400891-28-1 Solvents: Isopropanol; 2.5 H,80 °C
  标题:Hetero-Bimetallic Complexes Based On An Anthyridine Ligand Preparation And Catalytic Activity
  作者:Lin,Shih-Chieh Aaron; Liu,Yi-Hung; Peng,Shie-Ming; Liu,Shiuh-Tzung
  参考文献:Organometallics 日期:2020 卷标:39(1) 页码:123-131]
  
  98-80-6 + 13329-40-3 = 92-91-1
  反应条件:1.1 Reagents: Potassium Carbonate Catalysts: N-(2-Aminoethyl)-3-Aminopropyltrimethoxysilane (Mesoporous Silica-Supported,Palladium Complex),Palladium Diacetate Solvents: Dimethylformamide,Water; 20 Min,80 °C
  标题:Pd(Oac)2@sba-15/pren Nanoreactor: A Highly Active,Reusable And Selective Phosphine-Free Catalyst For Suzuki-Miyaura Cross-Coupling Reaction In Aqueous Media
  作者:Rostamnia,Sadegh; Xin,Hongchuan
  参考文献:Applied Organometallic Chemistry 日期:2013 卷标:27(6) 页码:348-352]
  
  98-80-6 + 99-90-1 = 92-91-1
  反应条件:1.1 Reagents: Potassium Carbonate Catalysts: (Sp-4-2)-[methylenebis[3-(4-Carboxylatophenyl)-1H-Imidazol-1-Yl-2(3H)-Ylidene]]B... Solvents: Water; 0.5 H,100 °C
  标题:Ph-Responsive Chelating N-Heterocyclic Dicarbene Palladium(Ii) Complexes: Recoverable Precatalysts For Suzuki-Miyaura Reaction In Pure Water
  作者:Li,Liuyi; Wang,Jinyun; Zhou,Chunshan; Wang,Ruihu; Hong,Maochun
  参考文献:Green Chemistry 日期:2011 卷标:13(8) 页码:2071-2077]
  
  98-80-6 + 99-91-2 = 92-91-1
  反应条件:1.1 Reagents: Tripotassium Phosphate Catalysts: Palladium Diacetate,18-Crown-6 Solvents: Dimethylformamide; 1 H,95 °C; 95 °C -> 20 °C1.2 10 Min,20 °C1.3 Solvents: Dimethylformamide; 7 H,95 °C
  标题:Bis(Tetrazolyl)Benzenes As Ligands In The Suzuki Reaction: Promoters Or Inhibitors?
  作者:Burukin,A. S.; Vasil'Ev,A. A.; Merkulova,N. L.; Struchkova,M. I.; Zlotin,S. G.
  参考文献:Russian Chemical Bulletin 日期:2006 卷标:55(1) 页码:118-122]
  
  10549-76-5 + 13329-40-3 + 47102-67-0 = 92-91-1
  反应条件:1.1 Catalysts: Di-μ-Chlorobis(η3-2-Propenyl)Dipalladium Solvents: Dimethylformamide1.2 Reagents: Water
  标题:Synthesis Of Unsymmetrical Biaryls By Palladium-Catalyzed Cross Coupling Reactions Of Arenes With Tetrabutylammonium Triphenyldifluorosilicate,A Hypervalent Silicon Reagent
  作者:Mowery,Molly E.; Deshong,Philip
  参考文献:Journal Of Organic Chemistry 日期:1999 卷标:64(9) 页码:3266-3270]
  
  98-80-6 + 99-91-2 = 92-91-1
  反应条件:1.1 Catalysts: Bis(Benzonitrile)Dichloropalladium,2925303-71-3 Solvents: Toluene; 12 H,Rt1.2 Reagents: Potassium Carbonate Solvents: Toluene,Water; 2 H,80 °C
  标题:Porous Supramolecular Assemblies For Efficient Suzuki Coupling Of Aryl Chlorides
  作者:Chen,Fang; Zheng,Liping; Li,Chen; Wang,Benlei; Wu,Qing; Et Al
  参考文献:Small 日期:2023 卷标:19(36)]
  
  98-80-6 + 99-90-1 = 92-91-1
  反应条件:1.1 Reagents: Triethylamine Catalysts: Palladium,2960271-97-8 (Complexes With Pd) Solvents: Water; 3 H,40 °C
  标题:Supramolecular Linear-Dendritic Nanoreactors: Synthesis And Catalytic Activity In "Green" Suzuki-Miyaura Reactions
  作者:Liu,Xin; Yavitt,F. Max; Gitsov,Ivan
  参考文献:Polymers (Basel 日期:2023 卷标:15(7)]
  
  98-80-6 + 99-90-1 = 92-91-1
  反应条件:1.1 Reagents: Potassium Carbonate Catalysts: 2905341-25-3 Solvents: Dichloromethane,Water; 0.5 H,25 °C
  标题:Sulfobetaine Inner Salt Type Double N-Heterocyclic Carbene Palladium Complex,Synthesis Method And Application Thereof As Catalyst In Suzuki Coupling Reaction
  参考文献:China]
  
  98-80-6 + 99-90-1 = 92-91-1
  反应条件:1.1 Reagents: Potassium Carbonate Catalysts: Tetrabutylammonium Bromide,2839708-99-3 Solvents: Water; 7 Min,100 °C
  标题:Benzothiazole-Based Palladium Complexes As Efficient Nano-Sized Catalysts For Microwave Hydrothermal Suzuki -Miyaura Cross-Couplings
  作者:Khormi,Afaf Y.; Abboud,Mohamed; Hamdy,Mohamed S.; Eissa,Murad; Shaaban,Mohamed R.
  参考文献:Journal Of Inorganic And Organometallic Polymers And Materials 日期:2023 卷标:33(1) 页码:105-119]
  
  98-80-6 + 13329-40-3 = 92-91-1
  反应条件:1.1 Reagents: Potassium Carbonate Catalysts: 2821077-20-5 Solvents: Butyl Ether; 7 H,140 °C
  标题:Recoverable Low Fluorine Content Palladium Complex-Catalyzed Suzuki-Miyaura And Sonogashira Coupling Reactions Under Thermomorphic Mode
  作者:Tessema,Eskedar; Fan,Yao-Wen; Chiu,Chiao-Fan; Elakkat,Vijayanath; Rahayu,Hening Asti; Et Al
  参考文献:Tetrahedron 日期:2022 卷标:122]
  
  98-80-6 + 99-90-1 = 92-91-1
  反应条件:1.1 Reagents: Potassium Carbonate Catalysts: Palladium Solvents: Ethanol; 1 H,80 °C1.2 1 H,Rt
  标题:Nanowire Networks Of Metal-Organosilicates As Reversible Pd(Ii) Reservoirs For Suzuki Coupling Reactions
  作者:Shao,Yu; Zeng,Hua Chun
  参考文献:Acs Applied Nano Materials 日期:2021 卷标:4(10) 页码:10886-10901

海关参考信息

• 2902600000-乙苯
  2912110000-甲醛
  2912120000-乙醛
  2912210000-苯甲醛
• 💡 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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