CAS: 943-73-7; H-Hophe-Oh

• 英文名称H-Hophe-Oh
• 中文名称L-高苯丙氨酸
• IUPAC名称(S)-2-amino-4-phenylbutanoic acid
• 其它别名(S)-2-氨基-4-苯基丁酸; L高苯丙氨酸
• CAS编号943-73-7
• MFCD编号:MFCD00002619
• EINECS号:213-403-3
• FDA UNII编号:8JYL44CC06
• 分子式:C10H13NO2
• 分子量:179.22
• 产品CID: 1993954
• 产品分类有机原料→生命科学→氨基酸及其衍生物→苯丙氨酸及其衍生物

• 相似结构搜索
• 产品信息参考;;;;
• InChIKey: JTTHKOPSMAVJFE-VIFPVBQESA-N
• InChI=1/C10H13NO2/c11-9(10(12)13)7-6-8-4-2-1-3-5-8/h1-5,9H,6-7,11H2,(H,12,13)/t9-/s3…
• 计算化学: 氢键受体数2.0氢键供体数2.0可旋转键数4.0

相似化合物

物理性质

• 熔点>300°C
• 沸点324.8°C at 760 mmHg
• 闪点150.2±25.9 °C
• 密度1.2±0.1 g/cm3
• PH:45 º (C=1, 3N HCl 19 °C)
• pKa:2.32±0.10(预测)
• PSA:63.32
• LogP:1.0311
• 旋光度45º(C=1,3NHCL19ºC)
• 折射率1.565
• 蒸汽压0.0±0.7 mmHg at 25°C
• 溶解性Soluble In Dilute Aqueous Acid.
• 敏感性常温常压下稳定，避免氧化物接触
• 外观形态白色至类白色固体
• 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生产各种抗血清剂,包括SPIRAPRIL(SPIRAPRIL),DELAPRIL (DELAPRIL) , IMIDAPRIR(IMIDAPRIAL)和QUINAPRIL等.

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
• 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.
• 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22-24/25
• 危险类别码S24/25:Prevent skin and eye contact.
• 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 L-Homophe-Oh 主要起始原料 Benzenebutanoic Acid, α-Amino-, Sodium Salt (1:1), (αs)-
• 1239710-15-6 = 943-73-7
  反应条件:1.1 Reagents: Hydrochloric Acid Solvents: Water; Rt; 20 H,Reflux
  标题:Asymmetric Synthesis Of Allylic Secondary Alcohols: A New General Approach For The Preparation Of α-Amino Acids
  作者:Drummond,Lorna J.; Sutherland,Andrew
  参考文献:Tetrahedron 日期:2010 卷标:66(29) 页码:5349-5356]
  
  63393-59-9 = 943-73-7
  反应条件:1.1 Reagents: Cobalt Chloride (Cocl2) Catalysts: Aminoacylase,Amino Acid Amide Racemase Solvents: Water; 1 H,Ph 8,37 °C1.2 Reagents: Hydrochloric Acid Solvents: Water; Ph 2
  标题:Enantioselective Synthesis Of L-Homophenylalanine By Whole Cells Of Recombinant Escherichia Coli Expressing L-Aminoacylase And N-Acylamino Acid Racemase Genes From Deinococcus Radiodurans Bcrc12827
  作者:Hsu,Shih-Kuang; Lo,Hsueh-Hsia; Kao,Chao-Hung; Lee,Dong-Sheng; Hsu,Wen-Hwei
  参考文献:Biotechnology Progress 日期:2006 卷标:22(6) 页码:1578-1584]
  
  168154-76-5 = 943-73-7
  反应条件:1.1 Reagents: Hydrogen Catalysts: Palladium
  标题:Amino Acid Anhydride Hydrochlorides As Acylating Agents In Friedel-Crafts Reaction: A Practical Synthesis Of L-Homophenylalanine
  作者:Lin,Wenqing; He,Ze; Zhang,Haile; Zhang,Xiaomei; Mi,Aiqiao; Et Al
  参考文献:Synthesis 日期:2001 卷标:(7) 页码:1007-1009]
  
  710-11-2 = 943-73-7
  反应条件:1.1 Reagents: Nad,Ammonium Formate,Potassium Hydroxide,Phosphoric Acid Catalysts: Dehydrogenase,Formate Dehydrogenase (Nadp) Solvents: Water; 15 - 20 H,Ph 8,Rt
  标题:Method For Preparing L-Homophenylalanine From 2-Oxo-4-Phenylbutyric Acid Or Its Ester With Homophenylalanine Dehydrogenase
  参考文献:China]
  
  168154-76-5 = 943-73-7
  反应条件:1.1 Reagents: Hydrogen,Hydrochloric Acid Catalysts: Palladium Solvents: Water; 48 H,Rt1.2 Reagents: Sodium Bicarbonate Solvents: Water; Ph 7
  标题:Improved Method Of Preparing 2(S)-Amino-4-Phenylbutyric Acid
  参考文献:World Intellectual Property Organization]
  
  710-11-2 = 943-73-7
  反应条件:1.1 Catalysts: Phenylalanine Dehydrogenase
  标题:Enzymic Manufacture Of L-2-Amino-4-Phenylbutyric Acid
  参考文献:Japan]
  
  139040-47-4 = 943-73-7
  反应条件:1.1 Reagents: Hydrogen Catalysts: Palladium
  标题:Hydrogen
  作者:Wilt,Jeremy C.; Collier,Steven J.
  参考文献:E-Eros Encyclopedia Of Reagents For Organic Synthesis 日期:2016 卷标:1 页码:1-18]
  
  56-84-8 = 943-73-7
  反应条件:1.1 Reagents: Phosphorus Trichloride Solvents: Acetic Acid,Acetic Anhydride; Rt; 20 H,40 °C1.2 Catalysts: Graphene Solvents: Benzene; 20 H,180 °C1.3 Reagents: Hydrochloric Acid Solvents: Water; -5 °C1.4 Reagents: Hydrochloric Acid,Oxygen Catalysts: Palladium Solvents: Water; 0.2 Mpa,90 °C1.5 Reagents: Ammonia; Ph 5.5 - 5.8,10 - 25 °C
  标题:Process For Preparation Of L-Homophenylalanine
  参考文献:China]
  
  120379-81-9 = 943-73-7
  反应条件:1.1 Reagents: Sodium Carbonate Catalysts: Manganese Dichloride,Hydrolase,Dihydropyrimidinase Solvents: Water; Ph 7 - 7.5,37 - 40 °C1.2 Reagents: Hydrochloric Acid Solvents: Water; Ph 7 - 7.2; Ph 5.5
  标题:Preparation Method Of L-Phenylalanine Or D-Phenylalanine
  参考文献:China]
  
  1678511-73-3 = 943-73-7
  反应条件:1.1 Reagents: Hydrogen Catalysts: Palladium Dihydroxide Solvents: Methanol; 7 H,45 °C
  标题:Process For Preparation Of 4-Phenyl-α-Aminobutyric Acid
  参考文献:China]
  
  710-11-2 = 943-73-7 [标题:Reaction Conditions
  标题:Industrial Production Of L-2-Amino-4-Phenylbutyric Acid From 2-Oxo-4-Phenylbutyric Acid By Paracoccus Denitrificans Containing Aminotransferase Activity
  作者:Senuma,Masaru; Nakamichi,Katsuhiko; Nabe,Koichi; Nishimoto,Shigeru; Tosa,Tetsuya
  参考文献:Applied Biochemistry And Biotechnology 日期:1989 卷标:22(2) 页码:141-50]
  
  85808-34-0 = 943-73-7
  反应条件:1.1 Reagents: Pyridoxal 5′-Phosphate Catalysts: Cobalt Chloride (Cocl2),2-Aminohexano-6-Lactam Racemase,L-Amino Acid Amidase Solvents: Water; 12 H,Ph 7,40 °C
  标题:Enzymatic Synthesis Of Chiral Phenylalanine Derivatives By A Dynamic Kinetic Resolution Of Corresponding Amide And Nitrile Substrates With A Multi-Enzyme System
  作者:Yasukawa,Kazuyuki; Asano,Yasuhisa
  参考文献:Advanced Synthesis & Catalysis 日期:2012 卷标:354(17) 页码:3327-3332]
  
  2923083-64-9 = 943-73-7
  反应条件:1.1 Reagents: Hydrogen Catalysts: Palladium Solvents: Methanol; 3 H,Rt
  标题:Preparation Method Of 2-(S)-Amino-4-Arylbutyric Acid Compound From 2-(S)-Amino-4-Oxo-4-Arylbutyric Acid By Reduction,Ring-Closing Esterification And Hydrogenation
  参考文献:China]
  
  105382-09-0 = 943-73-7
  反应条件:1.1 Reagents: Sodium Carbonate Solvents: Methanol; 5 Min,Rt
  标题:N-Acyliminium Cyclization As An Approach For An Asymmetric Synthesis Of The Pyrrolo[2,1-A]Benzazepine Ring System
  作者:Allin,Steven M.; Towler,Joannah M. R.; Elsegood,Mark R. J.; Saha,Basu; Page,Philip C. Bulman
  参考文献:Synthetic Communications 日期:2012 卷标:42(6) 页码:872-882]
  
  710-11-2 + 56-87-1 = 943-73-7
  反应条件:1.1 Catalysts: Pyridoxal 5′-Phosphate,Aspartate Aminotransferase Solvents: Water; 24 H,Ph 9.0,37 °C; 37 °C -> 100 °C
  标题:Asymmetrical Synthesis Of L-Homophenylalanine Using Engineered Escherichia Coli Aspartate Aminotransferase
  作者:Lo,Hsueh-Hsia; Hsu,Shih-Kuang; Lin,Wei-De; Chan,Nei-Li; Hsu,Wen-Hwei
  参考文献:Biotechnology Progress 日期:2005 卷标:21(2) 页码:411-415]
  
  253327-94-5 = 943-73-7
  反应条件:1.1 Reagents: Hydrochloric Acid1.2 Reagents: Sodium Acetate
  标题:Dpampp In Catalytic Asymmetric Reactions: Enantioselective Synthesis Of L-Homophenylalanine
  作者:Xie,Yinong; Lou,Rongliang; Li,Zhi; Mi,Aiqiao; Jiang,Yaozhong
  参考文献:Tetrahedron: Asymmetry 日期:2000 卷标:11(7) 页码:1487-1494]
  
  2379874-06-1 = 943-73-7
  反应条件:1.1 Reagents: Hydrogen Catalysts: Palladium Dihydroxide Solvents: Ethanol,Water; Rt -> 65 °C; 12 H,1 Bar,65 °C
  标题:Nitroalkanes As Versatile Nucleophiles For Enzymatic Synthesis Of Noncanonical Amino Acids
  作者:Romney,David K.; Sarai,Nicholas S.; Arnold,Frances H.
  参考文献:Acs Catalysis 日期:2019 卷标:9(9) 页码:8726-8730]
  
  100516-57-2 = 943-73-7
  反应条件:1.1 Reagents: Hydrogen Catalysts: Palladium Chloride Solvents: Ethanol,Tetrahydrofuran
  标题:Practical Asymmetric Syntheses Of α-Amino Acids Through Carbon-Carbon Bond Constructions On Electrophilic Glycine Templates
  作者:Williams,Robert M.; Sinclair,Peter J.; Zhai,Dongguan; Chen,Daimo
  参考文献:Journal Of The American Chemical Society 日期:1988 卷标:110(5) 页码:1547-57]
  
  1012-05-1 = 943-73-7
  反应条件:1.1 Reagents: Ammonium Formate,Ammonia Solvents: Water; Ph 7.21.2 Reagents: Oxygen Catalysts: Palladium,D-Amino Acid Oxidase,Catalase; 24 H,30 °C
  标题:Biocatalytic Deracemization Method For Preparing Non-Natural L-Amino Acid Using Immobilized D-Amino Acid Oxidase
  参考文献:China]
  
  104165-94-8 = 943-73-7
  反应条件:1.1 Reagents: Magnesium Stearate,Ethyl Acrylate-Methyl Methacrylate-Trimethylaminoethyl Methacrylate Chloride Cop... Solvents: Acetone; 25 °C; 3 H,25 °C1.2 Reagents: Nad,Ammonium Formate,Sodium Chloride Catalysts: Formate Dehydrogenase,Phenylalanine Dehydrogenase Solvents: Water; 12 H,Ph 8.0,25 °C1.3 Reagents: Sodium Hydroxide Solvents: Water; Ph 14,25 °C
  标题:Microparticle-Based Strategy For Controlled Release Of Substrate For The Biocatalytic Preparation Of L-Homophenylalanine
  作者:Zhang,Jielin; Tao,Shanshan; Zhang,Baojie; Wu,Xuri; Chen,Yijun
  参考文献:Acs Catalysis 日期:2014 卷标:4(5) 页码:1584-1587]
  
  46460-24-6 = 943-73-7 + 90940-54-8
  反应条件:1.1 Catalysts: Triacylglycerol Lipase Solvents: Water
  标题:Kinetic Resolution Of Amino Acid Esters Catalyzed By Lipases
  作者:Houng,Jer-Yiing; Wu,May-Ling; Chen,Shui-Tein
  参考文献:Chirality 日期:1996 卷标:8(6) 页码:418-422

海关参考信息

• 2902600000-乙苯
  2905121000-正丙醇
  2905130000-正丁醇
  2912110000-甲醛
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