CAS: 792-74-5; Dimethyl [1,1'-Biphenyl]-4,4'-Dicarboxylate

• 英文名称Dimethyl [1,1'-Biphenyl]-4,4'-Dicarboxylate
• 中文名称4,4'-联苯二甲酸二甲酯
• IUPAC名称Dimethyl biphenyl-4,4'-dicarboxylate
• 其它别名B.D.D.; Dimethyl biphenyl-4,4'-dicarboxylate; [1,1'-Biphenyl]-4,4'-dicarboxylic acid dimethyl ester
• CAS编号792-74-5
• MFCD编号:MFCD00017201
• EINECS号:212-341-4
• FDA UNII编号:K61BXA0U9C
• 分子式:C16H14O4
• 分子量:270.28
• 产品CID: 1787114
• 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: BKRIRZXWWALTPU-UHFFFAOYSA-N
• InChI=1S/C16H14O4/c1-19-15(17)13-7-3-11(4-8-13)12-5-9-14(10-6-12)16(18)20-2/h3-10H,1-2H3…
• 计算化学: 氢键受体数4.0氢键供体数0.0可旋转键数3.0

物理性质

• 熔点213-215°C
• 沸点373.4°C (粗估)
• 闪点204.7 °C
• 密度1.2117 (粗估)
• PSA:52.6
• LogP:2.9268
• 折射率1.5447 (估算)
• 蒸汽压1.06E-06 mmHg at 25 °C
• 溶解性Benzene (Slightly, Heated, Sonicated), Chloroform (Slightly, Heated, Sonicated)
• 外观形态白色至类白色固体
• 储存条件密封, 常温干燥保存
• 产品应用该化合物用于二甲基二氟基和二二二氟二氟苯-4,4-二氯苯基的合成试剂.

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P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
• UN编号NONH for all modes of transport
• 安全声明22-24/25
• 危险类别码May cause irritation; [MSDSonline] See Biphenyl.
• WGK Germany3

欧盟法规

上下游产品

合成工艺路线路线简述

• 92-86-4 = 792-74-5
  反应条件:1.1 Reagents: Triethylamine Catalysts: Bis(Benzonitrile)Dichloropalladium (Complex With (Diphenylphosphino)Methylated Polystyrene) Solvents: Tetrahydrofuran
  标题:Preparation Of Aromatic Dicarboxylic Acid Diesters
  参考文献:Japan]
  
  619-44-3 = 792-74-5
  反应条件:1.1 Reagents: Potassium Carbonate Catalysts: (Sp-4-3)-Chloro[4-[[1,4-Dioxo-4-[[3-(Trimethoxysilyl)Propyl]Amino]Butyl]Amino]-2... (Fe3O4 Mnp-Supported) Solvents: Dimethylformamide; 12 H,110 °C
  标题:The Role Of Magnetic Nanoparticles (Mnp) As Reducing Agents In An Mnp-Supported Pd-Catalyst For The Reductive Homocoupling Of Aryl Halides
  作者:Zheng,Jie; Lin,Shengyue; Jiang,Bi-Wang; Marder,Todd B.; Yang,Zhen
  参考文献:Canadian Journal Of Chemistry 日期:2012 卷标:90(1) 页码:138-144]
  
  161497-18-3 = 792-74-5
  反应条件:1.1 Reagents: Tetraethylammonium Iodide,Zinc Catalysts: Bis(Triphenylphosphine)Nickel Dichloride Solvents: Tetrahydrofuran
  标题:Cu,Ni,And Pd Mediated Homocoupling Reactions In Biaryl Syntheses: The Ullmann Reaction
  作者:Nelson,Todd D.; Crouch,R. David
  参考文献:Organic Reactions (Hoboken 日期:2004 卷标:63]
  
  619-44-3 = 792-74-5
  反应条件:1.1 Reagents: Hydroquinone,Cesium Carbonate Catalysts: Tris(2-Methylphenyl)Arsine,Palladium Diacetate Solvents: Dimethylacetamide1.2 Reagents: Hydrochloric Acid Solvents: Water
  标题:Palladium-Catalyzed (Ullmann-Type) Homocoupling Of Aryl Halides: A Convenient And General Synthesis Of Symmetrical Biaryls Via Inter- And Intramolecular Coupling Reactions
  作者:Hennings,D. David; Iwama,Tetsuo; Rawal,Viresh H.
  参考文献:Organic Letters 日期:1999 卷标:1(8) 页码:1205-1208]
  
  161497-18-3 = 792-74-5
  反应条件:1.1 Reagents: Tetraethylammonium Iodide Catalysts: Bis(Triphenylphosphine)Nickel Dichloride Solvents: Tetrahydrofuran
  标题:Aryl Mesylates In Metal Catalyzed Homocoupling And Cross-Coupling Reactions. 2. Suzuki-Type Nickel-Catalyzed Cross-Coupling Of Aryl Arenesulfonates And Aryl Mesylates With Arylboronic Acids
  作者:Percec,Virgil; Bae,Jin-Young; Hill,Dale H.
  参考文献:Journal Of Organic Chemistry 日期:1995 卷标:60(4) 页码:1060-5]
  
  619-42-1 + 99768-12-4 = 792-74-5
  反应条件:1.1 Reagents: Potassium Carbonate Catalysts: Cupd,Graphene (Oxide) Solvents: Ethanol,Water; 10 H,80 °C
  标题:Highly Active Pdcu/graphene Catalyst For An Efficient Suzuki Cross-Coupling Reaction
  作者:M.,Xiaojing; Gao,Lingfeng; Weng,Zhentao; Yang,Hua; Sun,Xu
  参考文献:New Journal Of Chemistry 日期:2020 卷标:44(47) 页码:20525-20529]
  
  787-70-2 = 792-74-5
  反应条件:1.1 Reagents: Potassium Carbonate Solvents: Acetone; 24 H,70 °C
  标题:Surface-Deactivated Core-Shell Metal-Organic Framework By Simple Ligand Exchange For Enhanced Size Discrimination In Aerobic Oxidation Of Alcohols
  作者:Kim,Seongwoo; Lee,Jooyeon; Jeoung,Sungeun; Moon,Hoi Ri; Kim,Min
  参考文献:Chemistry - A European Journal 日期:2020 卷标:26(34) 页码:7568-7572]
  
  3001-15-8 = 792-74-5
  反应条件:1.1 Reagents: Triethylamine Catalysts: Palladium Solvents: Methanol
  标题:Carbonylation Reactions Of Iodoarenes With Pamam Dendrimer-Palladium Catalysts Immobilized On Silica
  作者:Antebi,Shlomo; Arya,Prabhat; Manzer,Leo E.; Alper,Howard
  参考文献:Journal Of Organic Chemistry 日期:2002 卷标:67(19) 页码:6623-6631]
  
  161497-18-3 = 792-74-5
  反应条件:1.1 Reagents: Tetraethylammonium Iodide,Zinc Catalysts: Bis(Triphenylphosphine)Nickel Dichloride Solvents: Tetrahydrofuran
  标题:Aryl Mesylates In Metal-Catalyzed Homocoupling And Cross-Coupling Reactions. 1. Functional Symmetrical Biaryls From Phenols Via Nickel-Catalyzed Homocoupling Of Their Mesylates
  作者:Percec,Virgil; Bae,Jin-Young; Zhao,Mingyang; Hill,Dale H.
  参考文献:Journal Of Organic Chemistry 日期:1995 卷标:60(1) 页码:176-85]
  
  161497-18-3 = 792-74-5
  反应条件:1.1 Reagents: Lithium Bromide Catalysts: 2,2′-Bipyridine,Dichloro[1,2-Di(Methoxy-Ko)Ethane]Nickel Solvents: Dimethylformamide; 18 H,Rt
  标题:Ni- And Ni/pd-Catalyzed Reductive Coupling Of Lignin-Derived Aromatics To Access Biobased Plasticizers
  作者:Su,Zhi-Ming; Twilton,Jack; Hoyt,Caroline B.; Wang,Fei; Stanley,Lisa; Et Al
  参考文献:Acs Central Science 日期:2023 卷标:9(2) 页码:159-165]
  
  619-42-1 + 905966-40-7 = 792-74-5
  反应条件:1.1 Reagents: Tripotassium Phosphate Catalysts: Tricyclohexylphosphine,(Sp-4-3)-Chloro-1-Naphthalenylbis(Tricyclohexylphosphine)Nickel Solvents: Tetrahydrofuran; 20 H,23 °C
  标题:An Indefinitely Air-Stable σ-Ni(Ii) Precatalyst For Quantitative Cross-Coupling Of Unreactive Aryl Halides And Mesylates With Aryl Neopentylglycolboronates
  作者:Malineni,Jagadeesh; Jezorek,Ryan L.; Zhang,Na; Percec,Virgil
  参考文献:Synthesis 日期:2016 卷标:48(17) 页码:2795-2807]
  
  619-42-1 = 792-74-5
  反应条件:1.1 Reagents: Tetraethylammonium Iodide,Zinc Catalysts: Dibromo[1,2-Di(Methoxy-Ko)Ethane]Nickel,[n(E),N′(E)]-N,N′-1,2-Ethanediylidenebis[2,6-Bis(1-Methylethyl)Benzenamine Solvents: Tetrahydrofuran; 10 H,70 °C
  标题:New Catalyst For Homocoupling Of Aryl Halides Based On Nickel Complexes With Diazabutadiene Ligands
  作者:Valaeva,V. N.; Asachenko,A. F.; Kulyabin,P. S.; Flid,V. R.; Voskoboinikov,A. Z.
  参考文献:Russian Journal Of Organic Chemistry 日期:2011 卷标:47(11) 页码:1774-1776]
  
  161497-18-3 + 905966-40-7 = 792-74-5
  反应条件:1.1 Reagents: Tripotassium Phosphate Catalysts: Bis(1,5-Cyclooctadiene)Nickel,Tricyclohexylphosphine Solvents: Tetrahydrofuran; 4 H,25 °C
  标题:Ni(Cod)2/pcy3 Catalyzed Cross-Coupling Of Aryl And Heteroaryl Neopentylglycolboronates With Aryl And Heteroaryl Mesylates And Sulfamates In Thf At Room Temperature
  作者:Leowanawat,Pawaret; Zhang,Na; Resmerita,Ana-Maria; Rosen,Brad M.; Percec,Virgil
  参考文献:Journal Of Organic Chemistry 日期:2011 卷标:76(24) 页码:9946-9955]
  
  1126-46-1 + 905966-40-7 = 792-74-5
  反应条件:1.1 Reagents: Cesium Fluoride Catalysts: Palladium Diacetate,2-(Dicyclohexylphosphino)Biphenyl Solvents: 1,4-Dioxane; 18 H,25 °C
  标题:Two-Step,One-Pot Ni-Catalyzed Neopentylglycolborylation And Complementary Pd/ni-Catalyzed Cross-Coupling With Aryl Halides,Mesylates,And Tosylates
  作者:Wilson,Daniela A.; Wilson,Christopher J.; Rosen,Brad M.; Percec,Virgil
  参考文献:Organic Letters 日期:2008 卷标:10(21) 页码:4879-4882]
  
  99768-12-4 = 792-74-5
  反应条件:1.1 Catalysts: 2045170-75-8 Solvents: Ethanol; 6 H,22 °C
  标题:Efficient Homocoupling Of Aryl- And Alkenylboronic Acids In The Presence Of Low Loadings Of [{pd(μ-Oh)Cl(Ipr)}2]
  作者:Ostrowska,Sylwia; Rogalski,Szymon; Lorkowski,Jan; Walkowiak,Jedrzej; Pietraszuk,Cezary
  参考文献:Synlett 日期:2018 卷标:29(13) 页码:1735-1740]
  
  619-42-1 = 792-74-5
  反应条件:1.1 Reagents: Zinc,Lithium Chloride Catalysts: Trimethylaluminum,Cobalt Chloride (Cocl2),4,4′-Dimethoxy-2,2′-Bipyridine Solvents: Dimethylformamide,Acetonitrile,Toluene; 14 H,40 °C1.2 Reagents: Hydrochloric Acid Solvents: Water; 0 °C
  标题:Cobalt-Catalyzed Highly Regioselective Three-Component Arylcarboxylation Of Acrylate With Aryl Bromides And Carbon Dioxide
  作者:Hang,Wei; Liang,Nianjie; Liu,Yuzhou; Xi,Chanjuan
  参考文献:Chemsuschem 日期:2021 卷标:14(22) 页码:4941-4946]
  
  619-42-1 = 792-74-5
  反应条件:1.1 Reagents: 1,4-Dihydro-2,3,5,6-Tetramethyl-1,4-Bis(Trimethylsilyl)Pyrazine Catalysts: Bis(Acetylacetonato)Nickel Solvents: Toluene; 18 H,Rt; 80 °C1.2 Solvents: Hexane,Ethyl Acetate
  标题:Salt-Free Reduction Of Nonprecious Transition-Metal Compounds: Generation Of Amorphous Ni Nanoparticles For Catalytic C-C Bond Formation
  作者:Yurino,Taiga; Ueda,Yohei; Shimizu,Yoshiki; Tanaka,Shinji; Nishiyama,Haruka; Et Al
  参考文献:Angewandte Chemie 日期:2015 卷标:54(48) 页码:14437-14441]
  
  99768-12-4 = 792-74-5
  反应条件:1.1 Reagents: Oxygen Catalysts: Copper,Bis[μ-(1,10-Phenanthrolin-2-Olato-Kn1,Kn10:Ko2)]Di-,(Cu-Cu),Stereoisom... Solvents: Dimethylformamide; 20 H,Rt
  标题:Three-Coordinate Copper(I) 2-Hydroxy-1,10-Phenanthroline Dinuclear Complex Catalyzed Homocoupling Of Arylboronic Acids Towards Biphenyls Under Air Condition
  作者:Wang,Yan-Hong; Xu,Mei-Chen; Liu,Jie; Zhang,Ling-Juan; Zhang,Xian-Ming
  参考文献:Tetrahedron 日期:2015 卷标:71(52) 页码:9598-9601

海关参考信息

• 2906210000-苄醇
  2912110000-甲醛
  2912210000-苯甲醛
  2915110000-甲酸
• 💡 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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