CAS: 873-75-6; (4-Bromophenyl)Methanol

• 英文名称(4-Bromophenyl)Methanol
• 中文名称4-溴苄醇
• IUPAC名称(4-bromophenyl)methanol
• 其它别名(4-溴苯基)甲醇; 对溴苄醇; P-Bromobenzyl Alcohol
• CAS编号873-75-6
• MFCD编号:MFCD00004650
• EINECS号:212-851-7
• 分子式:C7H7BrO
• 分子量:187.03
• 产品CID: 1880206
• 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: VEDDBHYQWFOITD-UHFFFAOYSA-N
• InChI=1S/C7H7BrO/c8-7-3-1-6(5-9)2-4-7/h1-4,9H,5H2…
• 计算化学: 氢键受体数1.0氢键供体数1可旋转键数1

物理性质

• 熔点75-77°C
• 沸点267.8°C at 760 mmHg
• 闪点115.741±20.39 °C
• 密度1.565 g/cm3
• pKa:14.16±0.10(预测)
• PSA:20.23
• LogP:1.9414
• 折射率1.591
• 蒸汽压0.083Pa at 20°C
• 溶解性Dioxane: Soluble1G/10 Ml, Clear To Faintly Turbid, Colorless To Faintly Yellow
• 敏感性常温常压下稳定，避免氧化物接触
• 外观形态白色至微米色晶体或结晶粉末
• 储存条件密封, 常温干燥保存
• 产品应用该化合物用于合成以下混合物:已功能化的氢氧基末端,替代的聚氟苯二酚,对称棒化油,聚(9,9-二元二氯-2,7-二基)和聚(氢氧乙基甲基丙烯酸酯)的三块共聚物
• 性质描述白色结晶体,熔点75-78°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2
  严重眼刺激 类别2A
  水生慢性毒性 类别3
• 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.
  H412 |对水生生物有害并具有长期持续影响.
• 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
• 危险品标志Xi
• 风险等级Irritant
• 安全声明24/25
• 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-Bromobenzyl Alcohol 主要起始原料 4-Bromobenzoic Acid
• 1122-91-4 = 873-75-6
  反应条件:1.1 Reagents: Lithium Perchlorate Solvents: Ethanol,Water; 20 H,Rt
  标题:Water Oxidation Couples To Electrocatalytic Hydrogenation Of Carbonyl Compounds And Unsaturated Carbon-Carbon Bonds By Nickel
  作者:Behrouzi,Leila; Zand,Zahra; Fotuhi,Mobina; Kaboudin,Babak; Najafpour,Mohammad Mahdi
  参考文献:Scientific Reports 日期:2022 卷标:12(1)]
  
  1122-91-4 = 873-75-6
  反应条件:1.1 Reagents: Hydrogen Catalysts: (Oc-6-33)-Carbonyl[1,1′-[2-[(Diphenylphosphino-Kp)Methyl]-2-Methyl-1,3-Propanedi... Solvents: Heptane; 3 Bar; 20 - 30 Bar1.2 Reagents: Hydrogen; 5 H,30 Bar,Rt -> 100 °C
  标题:Hydrogenation And Reductive Amination Of Aldehydes Using Triphos Ruthenium Catalysts
  作者:Christie,Francesca; Zanotti-Gerosa,Antonio; Grainger,Damian
  参考文献:Chemcatchem 日期:2018 卷标:10(5) 页码:1012-1018]
  
  1122-91-4 = 873-75-6
  反应条件:1.1 Reagents: Hantzsch Ester Catalysts: Tris[3,5-Bis(Trifluoromethyl)Phenyl]Borane Solvents: 1,4-Dioxane; 12 H,25 °C
  标题:Organoborane-Catalyzed Hydrogenation Of Unactivated Aldehydes With A Hantzsch Ester As A Synthetic Nad(P)H Analogue
  作者:Hamasaka,Go; Tsuji,Hiroaki; Uozumi,Yasuhiro
  参考文献:Synlett 日期:2015 卷标:26(14) 页码:2037-2041]
  
  17100-68-4 = 873-75-6
  反应条件:1.1 Catalysts: N,N′-1,2-Ethanediylbis[n-Bromobenzenesulfonamide] Solvents: Methanol; 6 H,Rt
  标题:N,N'-Dibromo-N,N'-1,2-Ethanediylbis(Benzene Sulfonamide) As A Novel N-Bromo Reagent Catalyzed Tetrahydropyranylation/depyranylation Of Alcohols And Phenols Under Mild Conditions
  作者:Khazaei,Ardeshir; Rostami,Amin; Mahboubifar,Marjan
  参考文献:Catalysis Communications 日期:2007 卷标:8(3) 页码:383-388]
  
  1122-91-4 = 873-75-6
  反应条件:1.1 Reagents: Tributylborane Solvents: 1-Ethyl-3-Methylimidazolium Tetrafluoroborate
  标题:Reduction Of Aldehydes Using Trialkylboranes In Ionic Liquids
  作者:Kabalka,George W.; Malladi,Rama R.
  参考文献:Chemical Communications (Cambridge) 日期:2000 卷标:(22)]
  
  619-42-1 = 873-75-6
  反应条件:1.1 Catalysts: 2725020-49-3; 18 H,25 °C1.2 Reagents: Sodium Hydroxide Solvents: Water; Overnight,25 °C
  标题:Aluminum Hydroxide Secondary Building Units In A Metal-Organic Framework Support Earth-Abundant Metal Catalysts For Broad-Scope Organic Transformations
  作者:Feng,Xuanyu; Ji,Pengfei; Li,Zhe; Drake,Tasha; Oliveres,Pau; Et Al
  参考文献:Acs Catalysis 日期:2019 卷标:9(4) 页码:3327-3337]
  
  1122-91-4 = 873-75-6
  反应条件:1.1 Reagents: Phenylsilane Catalysts: [5-Butyl-1-Methyl-3-(2,4,6-Trimethylphenyl)-1H-1,2,3-Triazolium-4-Yl]Carbonyl(η5... Solvents: 1,2-Dichloroethane; 9 Min,60 °C1.2 Reagents: Tetrabutylammonium Fluoride Solvents: Chloroform-D
  标题:Triazolylidene Iron(Ii) Piano-Stool Complexes: Synthesis And Catalytic Hydrosilylation Of Carbonyl Compounds
  作者:Johnson,Chloe; Albrecht,Martin
  参考文献:Organometallics 日期:2017 卷标:36(15) 页码:2902-2913]
  
  1122-91-4 = 873-75-6
  反应条件:1.1 Catalysts: 1883514-40-6 Solvents: Isopropanol; 10 Min,82 °C1.2 Reagents: Potassium Hydroxide Solvents: Isopropanol; 0.5 H,82 °C
  标题:Piano-Stool Benzothiazol-2-Ylidene Ru(Ii) Complexes For Effective Transfer Hydrogenation Of Carbonyls
  作者:Oruc,Zeynep Ipek; Gok,Lutfiye; Turkmen,Hayati; Sahin,Onur; Buyukgungor,Orhan; Et Al
  参考文献:Journal Of Organometallic Chemistry 日期:2016 卷标:807 页码:36-44]
  
  1122-91-4 = 873-75-6
  反应条件:1.1 Reagents: Oxygen,Sodium Borohydride Catalysts: Imidazole,Manganese,(Acetato-O)[[4,4′,4′′,4′′′-(21H,23H-Porphine-5,10,15,20-Tetrayl)Tetra... (Carboxylated Multiwall Nanotubes) Solvents: Methanol; 5 Min,Rt
  标题:Manganese(Iii) Porphyrin Anchored Onto Multiwall Carbon Nanotubes: An Efficient And Reusable Catalyst For The Heterogeneous Reduction Of Aldehydes And Ketones
  作者:Rayati,Saeed; Bohloulbandi,Elaheh; Zakavi,Saeed
  参考文献:Journal Of Coordination Chemistry 日期:2016 卷标:69(4) 页码:638-649]
  
  1122-91-4 = 873-75-6
  反应条件:1.1 Reagents: Sodium Borohydride Catalysts: 1659248-89-1 Solvents: Methanol; 5 Min,Rt
  标题:Sodium Borohydride Reduction Of Aldehydes Catalyzed By An Oxovanadium(Iv) Schiff Base Complex Encapsulated In The Nanocavity Of Zeolite-Y
  作者:Rayati,Saeed; Bohloulbandi,Elaheh; Zakavi,Saeed
  参考文献:Inorganic Chemistry Communications 日期:2015 卷标:54 页码:38-40]
  
  1122-91-4 = 873-75-6
  反应条件:1.1 Reagents: (T-4)-Trihydro[1-Methyl-5-Phenyl-3-(Phenylmethyl)-1H-1,2,3-Triazolium-4-Yl]Boron Catalysts: Silica Solvents: Dichloromethane; 3 H,Rt
  标题:Mesoionic Carbene-Boranes
  作者:De Oliveira Freitas,Luiza Baptista; Eisenberger,Patrick; Crudden,Cathleen M.
  参考文献:Organometallics 日期:2013 卷标:32(22) 页码:6635-6638]
  
  1122-91-4 = 873-75-6
  反应条件:1.1 Catalysts: Iridium,Di-μ-Chlorodichlorobis[(1,2,3,4,5-η)-1,2,3,4,5-Pentamethyl-2,4-Cyclopen...,1-Butanaminium,N-[2-[[4-[[(2-Aminoethyl)Amino]Sulfonyl]Phenyl]Amino]-2-Oxoethyl... Solvents: Water; 1 H,80 °C1.2 Reagents: Sodium Formate; 1.5 H,80 °C
  标题:Synthesis Of Water-Soluble Monotosylated Ethylenediamines And Their Application In Ruthenium And Iridium-Catalyzed Transfer Hydrogenation Of Aldehydes
  作者:Zhou,Zhongqiang; Ma,Qiong; Zhang,Aiqing; Wu,Lamei
  参考文献:Applied Organometallic Chemistry 日期:2011 卷标:25(12) 页码:856-861]
  
  1122-91-4 = 873-75-6
  反应条件:1.1 Reagents: Sodium Borohydride Catalysts: Nickel,Silica Solvents: Methanol; 5 Min,0 °C1.2 Reagents: Water
  标题:Rapid And Selective Reduction Of Aldehydes,Ketones,Phenol,And Alkenes With Ni-Boride-Silica Catalysts System At Low Temperature
  作者:Rahman,Ateeq; Jonnalagadda,S. B.
  参考文献:Journal Of Molecular Catalysis A: Chemical 日期:2009 卷标:299(1-2) 页码:98-101]
  
  1122-91-4 = 873-75-6
  反应条件:1.1 Reagents: Sodium Borohydride; 10 Min,Rt
  标题:Fast And Efficient Method For Quantitative Reduction Of Carbonyl Compounds By Nabh4 Under Solvent-Free Conditions
  作者:Naimi-Jamal,M. R.; Mokhtari,J.; Dekamin,Mohammad G.
  参考文献:Proceedings Of The International Electronic Conference On Synthetic Organic Chemistry 日期:2007]
  
  17100-68-4 = 873-75-6
  反应条件:1.1 Catalysts: 1-Propanesulfonic Acid (Silica-Supported) Solvents: Methanol; 19 - 20 S,Rt
  标题:Parallel Synthesis In An Eof-Based Micro Reactor
  作者:Wiles,Charlotte; Watts,Paul
  参考文献:Chemical Communications (Cambridge 日期:2007 卷标:(46) 页码:4928-4930]
  
  1122-91-4 = 873-75-6
  反应条件:1.1 Reagents: Dichloro(Piperazine-Kn1,Kn4)Bis[tetrahydroborato(1-)-Kh,Kh′]Zirconium Solvents: Diethyl Ether; 45 Min,Rt
  标题:Zirconium Borohydride Piperazine Complex,An Efficient,Air And Thermally Stable Reducing Agent
  作者:Tajbakhsh,M.; Lakouraj,M. M.; Shirini,F.; Habibzadeh,S.; Nikdoost,A.
  参考文献:Tetrahedron Letters 日期:2004 卷标:45(16) 页码:3295-3299]
  
  1122-91-4 = 873-75-6
  反应条件:1.1 Reagents: Tributylstannane Solvents: Methanol1.2 Reagents: Hydrochloric Acid Solvents: Water
  标题:Solvent-Mediated Chemoselective Reduction Of Aldehydes By Using Tributyltin Hydride In Methanol,Aqueous Organic Solvents,Or Water: An Environmentally Benign Process
  作者:Kamiura,Koji; Wada,Makoto
  参考文献:Tetrahedron Letters 日期:1999 卷标:40(51) 页码:9059-9062

海关参考信息

• 2902300000-甲苯
  2905110000-甲醇
  2906210000-苄醇
• 💡 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

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