CAS: 97614-43-2; (2R,3S,4R,5R)-5-((Benzoyloxy)Methyl)-3-Fluorotetrahydrofuran-2,4-Diyl Dibenzoate

• 英文名称(2R,3S,4R,5R)-5-((Benzoyloxy)Methyl)-3-Fluorotetrahydrofuran-2,4-Diyl Dibenzoate
• 中文名称2-脱氧-2-氟-1,3,5-三-O-苯甲酰基-α-D-阿拉伯呋喃糖
• IUPAC名称(2R,3S,4R,5R)-5-((benzoyloxy)methyl)-3-fluorotetrahydrofuran-2,4-diyl dibenzoate
• 其它别名氯法拉滨中间体; 2-Deoxy-2-Fluoro-α-D-Arabinofuranose 1,3,5-Tribenzoate; 2'-Fluoro-2'-Deoxy-1,3,5-Tri-O-Benzoyl-α-D-Arabinofuranose; α-D-Arabinofuranose,2-Deoxy-2-Fluoro-,Tribenzoate
• CAS编号97614-43-2
• MFCD编号:MFCD00083339
• EINECS号:619-281-1
• 分子式:C26H21FO7
• 分子量:464.44
• 产品CID: 2022282
• 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: JOAHVPNLVYCSAN-UXGLMHHASA-N
• JOAHVPNLVYCSAN-PPTKZWKYSA-N…
• 计算化学: 氢键受体数7.0氢键供体数0.0可旋转键数7.0

物理性质

• 熔点74-77°C
• 沸点584.1°C at 760 mmHg
• 闪点295.7±25.0 °C
• 密度1.4±0.1 g/cm3
• PSA:88.13
• LogP:3.989
• 折射率1.607
• 蒸汽压0.0±1.6 mmHg at 25°C
• 溶解性Soluble In Chloroform Or Dichloromethane
• 外观形态白色至类白色粉末
• 储存条件置于阴暗处,密封, 常温干燥保存
• 产品应用该化合物用作实验室研究与开发以及化学和制药研究与发展进程;它作为氯法拉丁合成的中间体.

MSDS等安全信息

• GHS符号GHS07
• 警示词Warning
• 危险描述H302-H315-H319-H335
• 防范说明P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
• 危险品标志Xi
• 安全声明24/25
• WGK Germany3

上下游产品

合成工艺路线路线简述

• 22224-41-5 = 97614-43-2
  反应条件:1.1 Reagents: (Diethylamino)Sulfur Trifluoride Solvents: Dichloromethane; Rt; 12 H,Rt -> 40 °C; 12 H,40 °C1.2 Reagents: Sodium Bicarbonate Solvents: Dichloromethane,Water
  标题:Positron Emission Tomography Probe Demonstrates A Striking Concentration Of Ribose Salvage In The Liver
  作者:Clark,Peter M.; Flores,Graciela; Evdokimov,Nikolai M.; Mccracken,Melissa N.; Chai,Timothy; Et Al
  参考文献:Proceedings Of The National Academy Of Sciences Of The United States Of America 日期:2014 卷标:111(28)]
  
  22224-41-5 = 97614-43-2
  反应条件:1.1 Reagents: Deoxo-Fluor Solvents: Toluene1.2 Reagents: Sodium Bicarbonate Solvents: Water
  标题:Synthesis Of 2-Deoxy-2-Fluoro-Arabinose Derivatives
  参考文献:European Patent Organization]
  
  69339-86-2 = 97614-43-2
  反应条件:1.1 Reagents: (Diethylamino)Sulfur Trifluoride Solvents: Dichloromethane; 15 H,Reflux
  标题:Reactivity Between Acetone And Single-Stranded Dna Containing A 5'-Capped 2'-Fluoro-N7-Methyl Guanine
  作者:Mohan,Utpal; Burai,Ritwik; Mcnaughton,Brian R.
  参考文献:Tetrahedron Letters 日期:2014 卷标:55(22) 页码:3358-3360]
  
  314289-48-0 = 97614-43-2
  反应条件:1.1 Reagents: (Diethylamino)Sulfur Trifluoride Solvents: Dichloromethane; 15 H,Reflux
  标题:Synthesis And Structure Of Duplex Dna Containing The Genotoxic Nucleobase Lesion N7-Methylguanine
  作者:Lee,Seongmin; Bowman,Brian R.; Ueno,Yoshihito; Wang,Shuyu; Verdine,Gregory L.
  参考文献:Journal Of The American Chemical Society 日期:2008 卷标:130(35) 页码:11570-11571]
  
  97614-42-1 = 97614-43-2
  反应条件:1.1 Reagents: Triethylamine,Hydrofluoric Acid Solvents: Ethyl Acetate,Water; 3 H,80 °C1.2 Reagents: Triethylamine; 3 H,Heated
  标题:Synthesis Of Clofarabine
  作者:Chen,Lili; Cen,Junda
  参考文献:Zhongguo Yiyao Gongye Zazhi 日期:2006 卷标:37(8) 页码:508-510]
  
  97614-42-1 = 97614-43-2
  反应条件:1.1 Reagents: Triethylamine Trihydrofluoride Solvents: Ethyl Acetate; 3 H,Rt -> 60 °C; 1.5 H,70 °C1.2 Reagents: Water; Cooled
  标题:Pharmaceutical Application Of 2'-Fluoro-4'-Azido-Nucleoside Analog Or Its Salt
  参考文献:China]
  
  97614-42-1 = 97614-43-2
  反应条件:1.1 Reagents: Benzyltriethylammonium Chloride,Potassium Fluoride Solvents: Chloroform,Water; 4 H,60 °C1.2 Reagents: Ammonia Solvents: Water; Ph 7 - 8,Cooled
  标题:Improved Synthesis Of Clofarabine
  作者:Guo,Shunmin; Deng,Sishan; Qi,Yiping; Lin,Sui
  参考文献:Zhongguo Xiandai Yingyong Yaoxue 日期:2009 卷标:26(2) 页码:123-125]
  
  22224-41-5 = 97614-43-2
  反应条件:1.1 Reagents: Deoxo-Fluor Solvents: Dichloromethane; 50 °C
  标题:Sulfur,Trifluoro[2-Methoxy-N-(2-Methoxyethyl)Ethanaminato-Kn]-,(T-4)-
  作者:Cannon,Kevin C.; Krow,Grant R.
  参考文献:E-Eros Encyclopedia Of Reagents For Organic Synthesis 日期:2010 页码:1-7]
  
  97614-41-0 = 97614-43-2
  反应条件:1.1 Reagents: Triethylamine,Triethylamine Trihydrofluoride Solvents: Acetonitrile; 36 H,60 °C1.2 Reagents: Water
  标题:Preparation Of Thiouracil Nucleoside Analogs For Treatment Of Viruses And Cancer
  参考文献:India]
  
  22224-41-5 = 97614-43-2
  反应条件:1.1 Reagents: (Diethylamino)Sulfur Trifluoride Solvents: Dichloromethane
  标题:2'-Deoxy-2'-Fluoro-β-D-Arabinonucleosides And Oligonucleotides (2'F-Ana): Synthesis And Physicochemical Studies
  作者:Wilds,Christopher J.; Damha,Masad J.
  参考文献:Nucleic Acids Research 日期:2000 卷标:28(18) 页码:3625-3635]
  
  22224-41-5 = 97614-43-2
  反应条件:1.1 Reagents: (Diethylamino)Sulfur Trifluoride Solvents: Dichloromethane; 18 H,40 - 42 °C
  标题:Method For Synthesizing Nucleoside Analog Clofarabine
  参考文献:China]
  
  97614-42-1 = 97614-43-2
  反应条件:1.1 Reagents: Triethylamine Trihydrofluoride Solvents: Ethyl Acetate; Rt -> 60 °C; 3 H,60 °C; 1.5 H,70 °C1.2 Reagents: Sodium Chloride Solvents: Water; Cooled
  标题:Preparation Of 2'-Fluoro-4'-Substituted Nucleoside Analogs As Antiviral Agents
  参考文献:China]
  
  22224-41-5 = 97614-43-2
  反应条件:1.1 Reagents: (T-4)-(4-Carboxyphenyl)Trifluorosulfur Solvents: Dichloromethane; Cooled; Rt1.2 Reagents: Water; Cooled
  标题:Method For Preparing 2-Deoxy-2-Fluoro-α-D-Arabinofuranose Derivatives
  参考文献:China]
  
  97614-42-1 = 97614-43-2
  反应条件:1.1 Reagents: Triethylamine Trihydrofluoride Solvents: Ethyl Acetate; Rt; 3 H,60 °C; 1.5 H,70 °C
  标题:Synthesis Of 1,3,5-Tri-O-Benzoyl-2-Deoxy-2-Fluoro-α-D-Arabinofuranose
  作者:Zhu,Lihua; Chen,Qian; Xu,Yunfeng; Fan,Juzheng
  参考文献:Huaxi Yaoxue Zazhi 日期:2005 卷标:20(3) 页码:207-210]
  
  97614-42-1 = 97614-43-2
  反应条件:1.1 Reagents: Triethylamine Trihydrofluoride Solvents: Ethyl Acetate; 60 °C; 60 °C -> 70 °C1.2 Reagents: Triethylamine; 10 H,70 °C; 70 °C -> Rt1.3 Reagents: Sodium Bicarbonate Solvents: Water; Neutralized,Cooled
  标题:Process For Preparation Of Clofarabine Intermediate 2-Deoxy-2-Fluoro-3,5-Di-O-Benzoyl-α-D-Arabinofuranosyl Bromide
  参考文献:China]
  
  97614-42-1 = 97614-43-2
  反应条件:1.1 Reagents: Hydrofluoric Acid,Potassium Bifluoride Solvents: (+/-)-Propylene Glycol,Water; Rt -> 160 °C; 130 - 160 °C; 5 H,130 - 160 °C; Cooled1.2 Reagents: Water; 1 H,Cooled
  标题:Method For Preparing Clofarabine With High Yield
  参考文献:China]
  
  97614-50-1 = 97614-43-2
  反应条件:1.1 Reagents: Triethylamine Trihydrofluoride Solvents: Ethyl Acetate
  标题:Triethylamine Poly(Hydrogen Fluorides) In The Synthesis Of A Fluorinated Nucleoside Glycon
  作者:Chou,T. S.; Becke,Lisa M.; O'Toole,John C.; Carr,M. Austin; Parker,Bruce E.
  参考文献:Tetrahedron Letters 日期:1996 卷标:37(1) 页码:17-20]
  
  97614-42-1 = 97614-43-2
  反应条件:1.1 Reagents: Hydrofluoric Acid Catalysts: Iron(Iii) Acetylacetonate Solvents: 1,4-Dioxane
  标题:Preparation Of Fluoro-Sugars And Other Fluoro Compounds
  参考文献:World Intellectual Property Organization]
  
  22224-41-5 = 97614-43-2
  反应条件:1.1 Reagents: Deoxo-Fluor Solvents: Dichloromethane; 50 °C
  标题:Synthesis Of 2',3'-Dideoxy-2'-Fluoro-3'-Thioarabinothymidine And Its 3'-Phosphoramidite Derivative
  作者:Elzagheid,Mohamed I.; Tedeschi,Anna Lisa; Damha,Masad J.
  参考文献:Nucleosides 日期:2003 卷标:22(5-8) 页码:1343-1346]
  
  22224-41-5 = 97614-43-2
  反应条件:1.1 Reagents: Pyridine,Trifluoromethanesulfonic Acid Solvents: Acetonitrile; 0.5 H,Rt1.2 Reagents: Triethylamine,Triethylamine Trihydrofluoride; 18 H,50 °C1.3 Solvents: Water
  标题:Direct And Convenient Conversion Of Alcohols To Fluorides
  作者:Yin,Jingjun; Zarkowsky,Devin S.; Thomas,David W.; Zhao,Matthew M.; Huffman,Mark A.
  参考文献:Organic Letters 日期:2004 卷标:6(9) 页码:1465-1468

海关参考信息

• 2905122000-异丙醇
  2905310000-1,2-乙二醇
  2905320000-1,2-丙二醇
  2905399001-1,3-丙二醇
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• ➥ 防范代码详解
• ➥ 危险代码说明
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