CAS: 95-69-2; 4-Chloro-2-Methylaniline

• 英文名称4-Chloro-2-Methylaniline
• 中文名称4-氯-2-甲基苯胺
• IUPAC名称4-chloro-2-methylaniline
• 其它别名2-氨基-5-氯甲苯; 4氯邻甲苯胺; Fast Red Tr Base; 4-Chloro-2-Methylaniline
• CAS编号95-69-2
• MFCD编号:MFCD00007842
• EINECS号:202-441-6
• 分子式:C7H8ClN
• 分子量:141.6
• 产品CID: 2010736
• 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: CXNVOWPRHWWCQR-UHFFFAOYSA-N
• InChI=1S/C7H8ClN/c1-5-4-6(8)2-3-7(5)9/h2-4H,9H2,1H3…
• 计算化学: 氢键受体数1.0氢键供体数1可旋转键数0

物理性质

• 熔点24-27°C
• 沸点241°C at 760 mmHg
• 闪点99.44°C
• 密度1.2±0.1 g/cm3
• pKa:pK1:3.385(+1) (25°C)
• PSA:26.02
• LogP:2.23062
• 折射率1.585
• 蒸汽压0.0±0.5 mmHg at 25°C
• 溶解性Practically Insoluble In Water
• 敏感性避免与强氧化剂、酸类、酸酐、酰基氯接触。
• 外观形态白色或无色至棕色固体
• 储存条件请置于阴暗处, 惰性气氛中,室温
• 产品应用用作染料中间体.
• 性质描述灰白色固体或淡棕色油状液体.熔点29-30°C,沸点236-238°C(97.3kPa),折光率1.5848,闪点99°C,相对密度1.14.

MSDS等安全信息

• GHS象形图
• GHS符号GHS08 & GHS06 & GHS09;
  注释: Health hazard & Skull and crossbones & Environment
• 危险类别致癌性 类别1B
  致突变性 类别2
  急性毒性 类别3(吸入)
  急性毒性 类别3(经皮)
  急性毒性 类别3(经口)
  水生急性毒性 类别1
  水生慢性毒性 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
  严重眼刺激 类别2
  急性毒性 类别4(经皮)
  急性毒性 类别4(经口)
  特定目标器官毒性-单次接触 类别1
  特定目标器官毒性-重复接触 类别1
• 警示词Danger(危险)
• 危险描述H350 |可能致癌.
  H341 |怀疑导致遗传缺陷.
  H331 |吸入会中毒.
  H311 |皮肤接触会中毒.
  H301 |吞咽会中毒.
  H400 |对水生生物毒性极大.
  H410 |对水生生物毒性极大并具有长期持续影响.
  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.
  H312 |皮肤接触有害.
  H302 |吞咽有害.
  H370 |损害器官.
  H372 |长期或反复接触损害器官.
• 防范说明P261-P264-P270-P271-P273-P280-P302+P352-P304+P340-P330-P361+P364-P391-P405-P501
• 危险等级6.1
• UN编号2811.0
• 危险品标志T,N
• 包装等级Ⅲ
• 安全声明53-45-60-61
• 危险类别码45-23/24/25-50/53-68
• 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-Chloro-2-Methylaniline 主要起始原料 O-Toluidine
• 209919-30-2 = 95-69-2
  反应条件:1.1 Reagents: Trifluoroacetic Acid,[(1,1-Dimethylethoxy)Carbonyl]Azanyl 4-Methylbenzenesulfonate Solvents: 1,2-Dichloroethane; 4 H,Rt
  标题:Metal-Free Direct Transformation Of Aryl Boronic Acid To Primary Amines
  作者:Kumar,Puneet; Verma,Saumya; Rathi,Komal; Chandra,Dinesh; Prakash Verma,Ved; Et Al
  参考文献:European Journal Of Organic Chemistry 日期:2022 卷标:2022(27)]
  
  = 95-69-2
  反应条件:1.1 Reagents: Chlorosuccinimide,2-Bromo-2,2-Difluoroacetic Acid Catalysts: 2,4,5,6-Tetra(9H-Carbazol-9-Yl)Isophthalonitrile Solvents: Tetrahydrofuran; 1 Min,Rt
  标题:C-H Chlorination Of (Hetero)Anilines Via Photo/organo Co-Catalysis
  作者:Xie,Wuchen; Wang,Meng; Yang,Siyu; Chen,Yadong; Feng,Jie; Et Al
  参考文献:Organic & Biomolecular Chemistry 日期:2022 卷标:20(26) 页码:5319-5324]
  
  480438-47-9 = 95-69-2
  反应条件:1.1 Reagents: Cadmium Iodide Solvents: Tetrahydrofuran; 10 °C; 10 Min,10 °C; 10 °C -> Rt1.2 Reagents: 2-Propanone,O-[(4-Chlorophenyl)Sulfonyl]Oxime Catalysts: Cuprous Cyanide Solvents: Tetrahydrofuran; 30 Min,Rt1.3 Reagents: Hydrochloric Acid Solvents: Water; 24 H,Rt1.4 Reagents: Sodium Hydroxide Solvents: Water; Basified,Rt
  标题:Room-Temperature Copper-Catalyzed Electrophilic Amination Of Arylcadmium Iodides With Ketoximes
  作者:Korkmaz,Adem
  参考文献:Journal Of The Iranian Chemical Society 日期:2021 卷标:18(11) 页码:3119-3125]
  
  5367-28-2 = 95-69-2
  反应条件:1.1 Reagents: Sodium Borohydride Catalysts: Iron Oxide (Starch-Capped With Nickel),Nickel (Starch-Capped With Iron Oxide) Solvents: Water; 50 Min,Rt
  标题:Magnetically Separable Core-Shell Iron Oxide@nickel Nanoparticles As High-Performance Recyclable Catalysts For Chemoselective Reduction Of Nitroaromatics
  作者:Rathore,Puran Singh; Patidar,Rajesh; Shripathi,T.; Thakore,Sonal
  参考文献:Catalysis Science & Technology 日期:2015 卷标:5(1) 页码:286-295]
  
  = 95-69-2 + 87-63-8
  反应条件:1.1 Reagents: Chloramine-T Solvents: Ethanol,Water; 35 °C
  标题:Kinetics And Mechanism Of Halogenation Of Aniline,P-Toluidine And O-Toluidine Using N-Chloro-P-Toluene Sulphonamide (Cat) Under Buffer Conditions In Ethanol - Water Mixtures.
  作者:Satyadev,T. N. V. S. S.; Syama Sundar,B.; Radhakrishnamurti,P. S.
  参考文献:Iosr Journal Of Applied Chemistry 日期:2013 卷标:4(1) 页码:38-43]
  
  = 95-69-2
  反应条件:1.1 Reagents: Hydrochloric Acid,Nitric Acid,Hydrogen Peroxide Catalysts: Tungsten Oxide (Wo3),Silica (Propylamine-Functionalized) Solvents: Acetonitrile,Water; 4 H,Ph 3,298 K
  标题:Regiospecific Oxyhalogenation Of Aromatics Over Sba-15-Supported Nanoparticle Group Iv-Vi Metal Oxides
  作者:Saikia,L.; Rajesh,M.; Srinivas,D.; Ratnasamy,P.
  参考文献:Catalysis Letters 日期:2010 卷标:137(3-4) 页码:190-201]
  
  = 95-69-2
  反应条件:1.1 Reagents: Hydrochloric Acid,Hydrogen Peroxide Catalysts: Silica (Organofunctionalized) Solvents: Acetonitrile,Water; 4 H,Ph 2.5,298 K
  标题:Functionalized Sba-15 And Its Catalytic Applications In Selective Organic Transformations
  作者:Srinivas,Darbha; Saikia,Lakshi
  参考文献:Catalysis Surveys From Asia 日期:2008 卷标:12(2) 页码:114-130]
  
  77721-46-1 = 95-69-2
  反应条件:1.1 Catalysts: Dicobalt Octacarbonyl Solvents: Water; 4 H,Rt
  标题:Co2(Co)8 As Novel And Water-Tolerant Reagent For The Conversion Of Azides To Amines In Aqueous Media
  作者:Yadav,J. S.; Reddy,B. V. S.; Satheesh,G.; Rao,K. Raghavender
  参考文献:Chemistry Letters 日期:2005 卷标:34(3) 页码:340-341]
  
  5367-28-2 = 95-69-2
  反应条件:1.1 Reagents: Ammonium Chloride Catalysts: Nickel Solvents: Water; 2.1 H,Rt -> 90 °C; 90 °C -> Rt1.2 Solvents: Ethyl Acetate; 30 Min,Rt
  标题:Nitroarene Reduction Using Raney Nickel Alloy With Ammonium Chloride In Water
  作者:Bhaumik,Kankan; Akamanchi,K. G.
  参考文献:Canadian Journal Of Chemistry 日期:2003 卷标:81(3) 页码:197-198]
  
  611-22-3 = 95-69-2 + 87-63-8 + 956-31-0
  反应条件:1.1 Reagents: Hydrochloric Acid Solvents: Chloroform
  标题:The Self Oxidation Reduction Of N-Arylhydroxylamines
  作者:Yang,Chia Hsi; Lin,You Chung
  参考文献:Journal Of The Chinese Chemical Society (Taipei 日期:1987 卷标:34(1) 页码:19-24]
  
  676-58-4 = 95-69-2
  反应条件:1.1 Solvents: Tetrahydrofuran1.2 Reagents: Lithium Aluminum Hydride Catalysts: Palladium Solvents: Tetrahydrofuran
  标题:One-Pot Chemoselective Reductive Alkylation Of Nitroarenes: A New General Method Of Synthesis Of Alkylanilines
  作者:Bartoli,Giuseppe; Bosco,Marcella; Dal Pozzo,Renato; Petrini,Marino
  参考文献:Tetrahedron 日期:1987 卷标:43(18) 页码:4221-6]
  
  = 95-69-2 [标题:Reaction Conditions
  标题:Azasulfonium Salts. Intermediates In A General Procedure For The Alkylation Of Aromatic Amines
  作者:Gassman,Paul G.; Gruetzmacher,Gordon D.
  参考文献:Journal Of The American Chemical Society 日期:1974 卷标:96(17) 页码:5487-95]
  
  = 95-69-2
  反应条件:1.1 Reagents: 2-Propanone,O-[(2,4,6-Trimethylphenyl)Sulfonyl]Oxime Catalysts: Cuprous Cyanide Solvents: Tetrahydrofuran; 1.5 H,Rt1.2 Reagents: Hydrochloric Acid Solvents: Water; Overnight,Rt1.3 Reagents: Sodium Hydroxide Solvents: Water; Basified,Rt
  标题:Electrophilic Amination Of Diarylcadmium Reagents: The Effect Of Aminating Reagent'S Structure
  作者:Daskapan,Tahir; Korkmaz,Adem
  参考文献:Journal Of Chemical Sciences (Berlin 日期:2022 卷标:134(4)]
  
  5367-28-2 = 95-69-2
  反应条件:1.1 Reagents: Hydrogen Catalysts: Cobalt Solvents: Ethanol,Methanol; 2 H,2 Mpa,60 °C
  标题:In Situ-Formed Cobalt Nanoparticles Embedded Within Carbonaceous Matrix As Highly Efficient And Selective Catalysts For The Hydrogenation Of Nitroarenes
  作者:Zhuang,Xiuzheng; Liu,Jianguo; Zhong,Shurong; Ma,Longlong
  参考文献:Sustainable Chemistry And Pharmacy 日期:2022 卷标:29]
  
  43245-19-8 = 95-69-2
  反应条件:1.1 Reagents: 2-Propanone,O-[(4-Chlorophenyl)Sulfonyl]Oxime Solvents: Tetrahydrofuran; 10 Min,Rt1.2 Reagents: Hydrochloric Acid Solvents: Water; Rt
  标题:High Yielding Electrophilic Amination With Lower Order And Higher Order Organocuprates: Application Of Acetone O-(4-Chlorophenylsulfonyl)Oxime In The Construction Of The C-N Bond At Room Temperature
  作者:Korkmaz,Adem; Duran,Serdar
  参考文献:Synthetic Communications 日期:2021 卷标:51(14) 页码:2077-2087]
  
  = 95-69-2
  反应条件:1.1 Reagents: Lithium Chloride Catalysts: Cupric Chloride Solvents: Ethanol; 6 H,Reflux
  标题:Copper-Mediated Monochlorination Of Anilines And Nitrogen-Containing Heterocycles
  作者:Yang,Xue-Yan; Zhao,Hong-Yi; Mao,Shuai; Zhang,San-Qi
  参考文献:Synthetic Communications 日期:2018 卷标:48(20) 页码:2708-2714]
  
  480438-47-9 = 95-69-2
  反应条件:1.1 Reagents: (1R,2S,2′s,4S)-1,3,3-Trimethylspiro[bicyclo[2.2.1]Heptane-2,3′-Oxaziridine],(1R,2S,2′r,4S)-1,3,3-Trimethylspiro[bicyclo[2.2.1]Heptane-2,3′-Oxaziridine] Solvents: Toluene; 2 H,-45 °C1.2 Reagents: Ammonium Chloride Solvents: Water
  标题:Rapid Heteroatom Transfer To Arylmetals Utilizing Multifunctional Reagent Scaffolds
  作者:Gao,Hongyin; Zhou,Zhe; Kwon,Doo-Hyun; Coombs,James; Jones,Steven; Et Al
  参考文献:Nature Chemistry 日期:2017 卷标:9(7) 页码:681-688]
  
  611-23-4 = 95-69-2
  反应条件:1.1 Reagents: Cupric Chloride Catalysts: 2,6-Di-Tert-Butyl-4-Methylphenol Solvents: Acetonitrile; 2 H,Rt1.2 Reagents: Sodium Borohydride; 2 H,Rt1.3 Reagents: Water; Rt
  标题:Para-Selective Halogenation Of Nitrosoarenes With Copper(Ii) Halides
  作者:Van Der Werf,Angela; Selander,Nicklas
  参考文献:Organic Letters 日期:2015 卷标:17(24) 页码:6210-6213]
  
  5367-28-2 = 95-69-2
  反应条件:1.1 Reagents: Sodium Borohydride Catalysts: Cupd (Graphene Supported) Solvents: Ethanol,Water; 10 Min,0 °C; 1.5 H,50 °C
  标题:Pdcu Nanoparticles Supported On Graphene: An Efficient And Recyclable Catalyst For Reduction Of Nitroarenes
  作者:Feng,Yi-Si; Ma,Jing-Jing; Kang,Yu-Mei; Xu,Hua-Jian
  参考文献:Tetrahedron 日期:2014 卷标:70(36) 页码:6100-6105]
  
  = 95-69-2
  反应条件:1.1 Reagents: Hydrochloric Acid,Stannous Chloride Solvents: Ethanol1.2 Reagents: Sulfuric Acid,Potassium,μ-Hydroxy[μ-(Nitrato-O:O′)]Di-
  标题:Synthesis And Molecular Docking Studies Of New Substituted Indazole Derivatives For Anti-Breast Cancer Activity
  作者:Reddy,M. Thirupalu; Reddy,V. Hanuman; Reddy,R. Chenna Krishna; Reddy,V. Krishna; Reddy,Y. V. Rami
  参考文献:Pharma Chemica 日期:2014 卷标:6(6) 页码:411-417]
  
  209919-30-2 = 95-69-2
  反应条件:1.1 Reagents: Cesium Carbonate,O-(2,4-Dinitrophenyl)Hydroxylamine Solvents: Toluene; 24 H,25 °C
  标题:Elusive Metal-Free Primary Amination Of Arylboronic Acids: Synthetic Studies And Mechanism By Density Functional Theory
  作者:Zhu,Chen; Li,Gongqiang; Ess,Daniel H.; Falck,John R.; Kurti,Laszlo
  参考文献:Journal Of The American Chemical Society 日期:2012 卷标:134(44) 页码:18253-18256]
  
  = 95-69-2
  反应条件:1.1 Reagents: Cupric Chloride Solvents: 1-Hexyl-3-Methylimidazolium Chloride; 4 H,40 °C
  标题:Regioselective Chlorination And Bromination Of Unprotected Anilines Under Mild Conditions Using Copper Halides In Ionic Liquids
  作者:Wang,Han; Wen,Kun; Nurahmat,Nurbiya; Shao,Yan; Zhang,He; Et Al
  参考文献:Beilstein Journal Of Organic Chemistry 日期:2012 卷标:8 页码:744-748]
  
  = 95-69-2
  反应条件:1.1 Reagents: Nitric Acid Catalysts: Acetic Anhydride Solvents: Water; 10 °C; 0.5 H,10 °C1.2 1 H,20 - 25 °C; 30 Min,25 °C; 25 °C -> 50 °C; 5 H,50 °C1.3 Reagents: Iron,Hydrochloric Acid Solvents: Water; 10 Min,Rt; 10 Min,Rt1.4 Reagents: Sodium Carbonate; Ph 8 - 9
  标题:Synthesis Of 6-Chloro-3-Aminotoluene-4-Sulfonic Acid By Direct Nitration Of O-Chlorotoluene
  作者:He,Ermei; Jiang,Rishan
  参考文献:Huaxue Yanjiu Yu Yingyong 日期:2011 卷标:23(9) 页码:1273-1274]
  
  = 95-69-2 [标题:Reaction Conditions
  标题:Halide Ion Trapping Of Nitrenium Ions Formed In The Bamberger Rearrangement Of N-Arylhydroxylamines. Lifetime Of The Parent Phenylnitrenium Ion In Water
  作者:Fishbein,James C.; Mcclelland,Robert A.
  参考文献:Canadian Journal Of Chemistry 日期:1996 卷标:74(7) 页码:1321-1328]
  
  = 95-69-2 [标题:Reaction Conditions
  标题:Stereoselectivity In Central Analgesic Action Of Tocainide And Its Analogs
  作者:Franchini,Carlo; Noja,Francesca Chiaia; Corbo,Filomena; Lentini,Giovanni; Tortorella,Vincenzo; Et Al
  参考文献:Chirality 日期:1993 卷标:5(3) 页码:135-42]
  
  120-66-1 = 95-69-2 [标题:Reaction Conditions
  标题:The Preparation Of 14C-Chlorophenamidine-Base
  作者:Guan,Yuanmei; Lu,Liyi; Wang,Xiulan; Ma,Xinxuan
  参考文献:Yuanzineng Nongye Yingyong 日期:1986 卷标:(3) 页码:49-51]
  
  = 95-69-2 [标题:Reaction Conditions
  标题:A New Approach To The Synthesis Of N-Arylated Aromatic Amines - A Novel Carbazole Synthesis
  作者:Atta-Ur-Rahman; Firdous,Sadiqa
  参考文献:Journal Of The Chemical Society Of Pakistan 日期:1981 卷标:3(1) 页码:31-3

海关参考信息

• 2902300000-甲苯
  2903919090-氯苯
• 💡 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

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
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• ➥ REACH监管