CAS: 84199-61-1; 3-Acetyl-2-Bromopyridine

• 英文名称3-Acetyl-2-Bromopyridine
• 中文名称3-乙酰基-2-溴吡啶
• IUPAC名称1-(2-bromopyridin-3-yl)ethan-1-one
• 其它别名3-Acetyl-2-Bromopyridine; 1-(2-Bromopyridin-3-yl)Ethanone; 1-(2-Bromopyridin-3-yl)Ethan-1-One; 1-(2-Bromo-3-Pyridyl)Ethanone; Ethanone, 1-(2-Bromo-3-Pyridinyl)-; 1-(2-Bromo-3-Pyridinyl)Ethanone; 3-(2-Bromopyridyl) Methyl Ketone; 3-Acetyl-
• CAS编号84199-61-1
• MFCD编号:MFCD04114370
• EINECS号:685-036-0
• 分子式:C7H6BrNO分子量:200.03
• 产品CID: 1830324
• 产品分类有机原料→分子砌块→芳杂环类化合物→吡啶类化合物

• 相似结构搜索
• InChIKey: VYJZSPNXTDPUJW-UHFFFAOYSA-N
• InChI=1S/C7H6BrNO/c1-5(10)6-3-2-4-9-7(6)8/h2-4H,1H3
• 计算化学: 氢键受体数2.0氢键供体数*可旋转键数1.0

相似化合物

物理性质

• 沸点115 °C at 7 mmHg
• 闪点>110°C
• 密度1.5±0.1 g/cm3
• pKa:-1.01±0.10(预测)
• PSA:29.96
• LogP:2.0467
• 折射率1.558
• 蒸汽压0.0±0.6 mmHg at 25°C
• 外观形态液体
• 储存条件在惰性气体(氮气或氩气)下 2-8°C
• 产品应用该化合物用于HIV-1反转转转酶抑制剂合成.

MSDS等安全信息

• GHS象形图
• GHS符号GHS07;
  注释: Exclamation mark
• 危险类别急性毒性 类别4(经口)
  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H302 |吞咽有害.
  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-P330-P362+P364-P405-P501
• UN编号NONH for all modes of transport
• 危险品标志Xn
• 安全声明26
• 危险类别码22-36/37/38
• WGK Germany1

欧盟法规

上下游产品

合成工艺路线路线简述

• 84199-57-5 = 84199-61-1
  反应条件:1.1 Reagents: Chromium Trioxide Solvents: Acetone; Rt; 18 H,Rt1.2 Reagents: Sodium Hydroxide Solvents: Hexane,Water; 30 Min,Rt
  标题:Approach To 5-Substituted 6,7,8,9-Tetrahydro-5H-Pyrido[3,2-C]Azepines
  作者:Subota,Andrii I.; Artamonov,Oleksiy S.; Gorlova,Alina; Volochnyuk,Dmitriy M.; Grygorenko,Oleksandr O.
  参考文献:Tetrahedron Letters 日期:2017 卷标:58(20) 页码:1989-1991]
  
  84199-57-5 = 84199-61-1
  反应条件:1.1 Reagents: Chromium Trioxide
  标题:Regioselective Synthesis And Applications Of An α-Bromopyridine Carbanion. Opening Of The Pyridine Ring Resulting From Nucleophilic Attack
  作者:Marsais,Francis; Laperdrix,Bruno; Guengoer,Timur; Mallet,Marc; Queguiner,Guy
  参考文献:Journal Of Chemical Research 日期:1982 卷标:(10) 页码:278-9]
  
  84199-57-5 = 84199-61-1
  反应条件:1.1 Reagents: Chromium Trioxide Solvents: Acetone; -70 - 25 °C
  标题:Silver-Catalysed Intramolecular Cyclisation Of 2-Alkynylacetophenones And 3-Acetyl-2-Alkynylpyridines In The Presence Of Ammonia
  作者:Dell'Acqua,Monica; Abbiati,Giorgio; Arcadi,Antonio; Rossi,Elisabetta
  参考文献:Organic & Biomolecular Chemistry 日期:2011 卷标:9(22) 页码:7836-7848]
  
  84199-57-5 = 84199-61-1
  反应条件:1.1 Reagents: Dipyridinium Dichromate Solvents: Dimethylformamide; 18 H,Rt
  标题:One-Pot Asymmetric Synthesis Of Alkylidene 1-Alkylindan-1-Ols Using Bronsted Acid And Palladium Catalysis
  作者:Faggyas,Reka J.; Calder,Ewen D. D.; Wilson,Claire; Sutherland,Andrew
  参考文献:Journal Of Organic Chemistry 日期:2017 卷标:82(21) 页码:11585-11593]
  
  128071-75-0 = 84199-61-1
  反应条件:1.1 Solvents: Diethyl Ether; 0 °C1.2 Reagents: 1-Piperidinocyclohexanecarbonitrile Solvents: Dichloromethane; Rt
  标题:Metal-Free Visible Light-Promoted Synthesis Of Isothiazoles: A Catalytic Approach For N-S Bond Formation From Iminyl Radicals Under Batch And Flow Conditions
  作者:Cabrera-Afonso,Maria Jesus; Cembellin,Sara; Halima-Salem,Adnane; Berton,Mateo; Marzo,Leyre; Et Al
  参考文献:Green Chemistry 日期:2020 卷标:22(20) 页码:6792-6797

海关参考信息

• 2912110000-甲醛
  2912120000-乙醛
  2933310010-吡啶
  2914190090-其他无环酮
• 💡 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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• ➥ 象形图和危险代码
• ➥ 防范代码详解
• ➥ 危险代码说明
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