CAS: 93246-53-8; 3-Fluoro-4-Morpholinoaniline

• 英文名称3-Fluoro-4-Morpholinoaniline
• 中文名称3-氟-4-吗啉基苯胺
• IUPAC名称3-fluoro-4-morpholinoaniline
• 其它别名4-(2-氟-4-氨苯基)吗啉; Linezolid Intermediate
• CAS编号93246-53-8
• MFCD编号:MFCD02571270
• EINECS号:676-003-1
• FDA UNII编号:S59MCD5UHX
• 分子式:C10H13FN2O
• 分子量:196.22
• 产品CID: 1970832
• 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: FQGIBHQUVCGEAC-UHFFFAOYSA-N
• InChI=1S/C10H13FN2O/c11-9-7-8(12)1-2-10(9)13-3-5-14-6-4-13/h1-2,7H,3-6,12H2…
• 计算化学: 氢键受体数3.0氢键供体数1.0可旋转键数1.0

物理性质

• 熔点121-123°C
• 沸点364.9°C at 760 mmHg
• 闪点174.5±27.9 °C
• 密度1.2±0.1 g/cm3
• pKa:6.53±0.40(预测)
• PSA:38.49
• LogP:1.2445
• 折射率1.571
• 蒸汽压0.0±0.8 mmHg at 25°C
• 溶解性Chloroform, Methanol
• 外观形态类白色至棕色固体
• 储存条件请置于阴暗处, 惰性气氛中,室温
• 产品应用该化合物用作治疗肺炎,皮肤和皮肤结构感染的氧化氮素类抗生素,以及抗肠道菌菌菌感染的范康辛抗菌素)的一个重要中间体.

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
  水生慢性毒性 类别4
  急性毒性 类别4(吸入)
  急性毒性 类别4(经皮)
  急性毒性 类别4(经口)
  严重眼刺激 类别2A
• 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.
  H413 |可能对水生生物造成长期有害影响.
  H332 |吸入有害.
  H312 |皮肤接触有害.
  H302 |吞咽有害.
• 防范说明P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
• 危险等级IRRITANT
• 危险品标志Xi
• 安全声明H302+H312+H332,H315, H319

欧盟法规

上下游产品

合成工艺路线路线简述

• 2689-39-6 = 93246-53-8
  反应条件:1.1 Catalysts: Gold Solvents: Water; 60 Min,Rt1.2 Reagents: Sodium Borohydride Solvents: Water; Rt
  标题:Gold Nanoparticles Supported On Mesostructured Oxides For The Enhanced Catalytic Reduction Of 4-Nitrophenol In Water
  作者:Shanmugaraj,Krishnamoorthy; Bustamante,Tatiana M.; Torres,Cecilia C.; Campos,Cristian H.
  参考文献:Catalysis Today 日期:2022 卷标:388 页码:388-389]
  
  2689-39-6 = 93246-53-8
  反应条件:1.1 Reagents: Hydrogen Catalysts: Palladium Solvents: Ethanol; 18 H,1 Atm,Rt
  标题:Preparation Of N-Morpholinylphenyl-N-(Piperidinylmethyl)Acetamide Derivatives And Related Compounds As Glyt1 Transporter Inhibitors For The Treatment Of Mental Disorders
  参考文献:World Intellectual Property Organization]
  
  2689-39-6 = 93246-53-8
  反应条件:1.1 Reagents: Hydrogen Catalysts: Palladium Solvents: Ethanol; 18 H,Rt
  标题:Preparation Of N-Morpholinylphenyl-N-(Piperidinylmethyl)Propenamide Derivatives And Related Compounds As Glyt1 Transporter Inhibitors For The Treatment Of Neurological And Neuropsychiatric Disorders
  参考文献:World Intellectual Property Organization]
  
  2689-39-6 = 93246-53-8
  反应条件:1.1 Reagents: Hydrogen Catalysts: Palladium Solvents: Ethanol; 18 H,Rt
  标题:Preparation Of (Morpholinyl)Phenyl Azabicyclooctyl Ureas As Glyt1 Transporter Inhibitors For Treating Neurological Disorders
  参考文献:World Intellectual Property Organization]
  
  2689-39-6 = 93246-53-8
  反应条件:1.1 Reagents: Hydrogen Catalysts: Palladium Solvents: Ethanol; 18 H,Rt
  标题:Preparation Of Piperazine(Thio)Carboxamides As Inhibitors Of Hematopoietic Prostaglandin D Synthase
  参考文献:World Intellectual Property Organization]
  
  2689-39-6 = 93246-53-8
  反应条件:1.1 Catalysts: Iron(Ii) Acetylacetonate,3,7-Bis[2-(Diphenylphosphino)Ethyl]Octahydro-1,5-Diphenyl-1,5,3,7-Diazadiphospho... Solvents: Tetrahydrofuran; 30 Min,Rt1.2 Reagents: Hydrogen Solvents: Isopropanol; 48 H,30 Atm,100 °C
  标题:Homogenous Iron-Catalysed Hydrogenation Of Polar Substrates With Precise Chemoselectivity
  作者:Duan,Ya-Nan; Zeng,Yiqun; Cui,Zhikai; Wen,Jialin; Zhang,Xumu
  参考文献:Journal Of Catalysis 日期:2023 卷标:417 页码:109-115]
  
  2689-39-6 = 93246-53-8
  反应条件:1.1 Reagents: Hydrogen Catalysts: Palladium Solvents: Methanol; 5 H,30 Psi,Rt
  标题:Synthesis,Characterization And Biological Evaluation Of N-(4-Morpholin-3-Fluorophenyl)-N-(Furan-2-Ylmethyl)-2-Supstituted Phenoxypropanamide Derivatives
  作者:Velupillai,Loganathan; Shingare,M. S.; Mane,D. V.
  参考文献:International Journal Of Pharma And Bio Sciences 日期:2015 卷标:6(4) 页码:340-348]
  
  2689-39-6 = 93246-53-8
  反应条件:1.1 Reagents: Iron Chloride (Fecl3),Hydrazine Hydrate (1:1) Solvents: Tetrahydrofuran; Rt -> Reflux; 4 H,Reflux; Reflux -> Rt
  标题:Synthesis Of Linezolid
  作者:Fu,Xiao-Dong; He,Qiu; Xu,Yong-Xiang; Chen,Yue; Wan,Rong
  参考文献:Jingxi Huagong 日期:2013 卷标:30(8) 页码:920-924]
  
  2689-39-6 = 93246-53-8
  反应条件:1.1 Reagents: Hydrogen Catalysts: Palladium Solvents: Ethyl Acetate; 2 H,Rt
  标题:Highlights Of The Structure-Activity Relationships Of Benzimidazole Linked Pyrrolidines Leading To The Discovery Of The Hepatitis C Virus Ns5A Inhibitor Pibrentasvir (Abt-530)
  作者:Wagner,Rolf; Randolph,John T.; Patel,Sachin V.; Nelson,Lissa; Matulenko,Mark A.; Et Al
  参考文献:Journal Of Medicinal Chemistry 日期:2018 卷标:61(9) 页码:4052-4066]
  
  1321455-47-3 = 93246-53-8
  反应条件:1.1 Reagents: Silica Solvents: Ethanol,Water; 2 H,Rt
  标题:Highly Efficient Chemoselective N-Tbs Protection Of Anilines Under Exceptional Mild Conditions In The Eco-Friendly Solvent 2-Methyltetrahydrofuran
  作者:Pace,Vittorio; Alcantara,Andres R.; Holzer,Wolfgang
  参考文献:Green Chemistry 日期:2011 卷标:13(8) 页码:1986-1989]
  
  2689-39-6 = 93246-53-8
  反应条件:1.1 Reagents: Hydrogen Catalysts: Palladium Solvents: Ethanol; 18 H,1 Atm,Rt
  标题:Preparation Of Piperidinylamides As Glycine Transporter Inhibitors
  参考文献:World Intellectual Property Organization]
  
  2689-39-6 = 93246-53-8
  反应条件:1.1 Reagents: Hydrogen Catalysts: Palladium Solvents: Ethanol,Ethyl Acetate; Rt
  标题:Preparation Of 4-(Imidazol-5-Yl)-2-Anilinopyrimidines As Agents For The Inhibition Of Cell Proliferation
  参考文献:World Intellectual Property Organization]
  
  2689-39-6 = 93246-53-8
  反应条件:1.1 Reagents: Hydrogen Catalysts: Palladium Solvents: Ethanol; 18 H,Rt
  标题:Preparation Of (Piperidinyl)(Morpholinyl)Phenyl Ureas As Glyt1 Transporter Inhibitors For Treating Neurological Disorders
  参考文献:World Intellectual Property Organization]
  
  588708-63-8 = 93246-53-8
  反应条件:1.1 Reagents: Hydrogen Catalysts: Palladium Dihydroxide Solvents: Methanol; 1 H,Rt
  标题:Synthesis Of Dihydrooxazole Analogues Derived From Linezolid
  作者:Einsiedel,Jurgen; Schoerner,Christoph; Gmeiner,Peter
  参考文献:Tetrahedron 日期:2003 卷标:59(19) 页码:3403-3407]
  
  2689-39-6 = 93246-53-8
  反应条件:1.1 Reagents: Potassium Carbonate,Sodium Borohydride Catalysts: Palladium,2954730-92-6 Solvents: Methanol,Water; 5 Min,450 - 500 Psi,Rt
  标题:Continuous Ligand-Free Catalysis Using A Hybrid Polymer Network Support
  作者:Davis,Bradley A.; Genzer,Jan; Efimenko,Kirill; Abolhasani,Milad
  参考文献:Jacs Au 日期:2023 卷标:3(8) 页码:2226-2236]
  
  2689-39-6 = 93246-53-8
  反应条件:1.1 Reagents: Potassium Carbonate,Sodium Borohydride Catalysts: Palladium,2866309-20-6 Solvents: Methanol,Water; Rt
  标题:Intensified Hydrogenation In Flow Using A Poly(β-Cyclodextrin) Network-Supported Catalyst
  作者:Davis,Bradley A.; Bennett,Jeffrey A.; Genzer,Jan; Efimenko,Kirill; Abolhasani,Milad
  参考文献:Acs Sustainable Chemistry & Engineering 日期:2022 卷标:10(48) 页码:15987-15998]
  
  2689-39-6 = 93246-53-8
  反应条件:1.1 Reagents: Hydrogen Catalysts: Palladium Solvents: Ethanol; 24 H,Rt
  标题:New Method For Preparation Of Linezolid
  参考文献:China]
  
  2689-39-6 = 93246-53-8
  反应条件:1.1 Reagents: Hydrogen Catalysts: Palladium Solvents: Ethanol; 24 H,Rt
  标题:New Synthetic Method Of Linezolid
  作者:Chen,Qing; Zhang,Yongjun; Chen,Wei; Zhang,Xingxian
  参考文献:Zhongguo Yaowu Huaxue Zazhi 日期:2010 卷标:20(4) 页码:287-289]
  
  2689-39-6 = 93246-53-8
  反应条件:1.1 Reagents: Hydrogen Catalysts: Iron Oxide (Fe2O3) (Lignin Residue-Derived Carbon-Supported) Solvents: Tetrahydrofuran,Water; 24 H,35 Bar,120 °C
  标题:Lignin Residue-Derived Carbon-Supported Nanoscale Iron Catalyst For The Selective Hydrogenation Of Nitroarenes And Aromatic Aldehydes
  作者:Sarki,Naina; Kumar,Raju; Singh,Baint; Ray,Anjan; Naik,Ganesh; Et Al
  参考文献:Acs Omega 日期:2022 卷标:7(23) 页码:19804-19815]
  
  2689-39-6 = 93246-53-8
  反应条件:1.1 Reagents: Hydrogen Catalysts: Palladium Solvents: Ethyl Acetate; 30 S,0.5 Mpa,80 °C
  标题:Method For Synthesizing 3-Fluoro-4-(4-Morpholinyl)Aniline By Using Microchannel Reactor
  参考文献:China

海关参考信息

• 2909110000-乙醚
  2922110001-单乙醇胺
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