CAS: 83435-58-9; Boc-D-Prolinol

• 英文名称Boc-D-Prolinol
• 中文名称Boc-D-脯氨醇
• IUPAC名称tert-butyl (R)-2-(hydroxymethyl)pyrrolidine-1-carboxylate
• 其它别名(R)-N-Boc Prolinol ; (R)-(+)-1-Boc-2-Pyrrolidinemethanol ; (R)-Tert-Butyl (Hydroxymethyl)Pyrrolidine-1-Carboxylate ; (+) N-Boc-D-Prolinol ; (R)-2-(Hydroxymethyl)Pyrrolidine-1-Carboxylic Acid Tert-Butyl Ester ; Tert-Butyl (2R)-2-(Hydroxymethyl)-1-Pyrrolidi
• CAS编号83435-58-9
• MFCD编号:MFCD00040580
• EINECS号:626-169-6
• 分子式:C10H19NO3
• 分子量:201.26
• 产品CID: 1823184
• 产品分类生物化工 → 氨基酸及其衍生物 → 氨基醇类衍生物

• 相似结构搜索
• InChIKey: BFFLLBPMZCIGRM-MRVPVSSYSA-N
• InChI=1S/C10H19NO3/c1-10(2,3)14-9(13)11-6-4-5-8(11)7-12/h8,12H,4-7H2,1-3H3/t8-/m1/s1…
• 计算化学: 氢键受体数3.0氢键供体数1.0可旋转键数3.0

物理性质

• 熔点59-62 °C
• 沸点289.5±13.0 °C at 760 mmHg
• 闪点128.9±19.8 °C
• 密度1.1±0.1 g/cm3
• PH:49 º (589nm, =1.3, CHCl3)
• pKa:14.77±0.10(预测)
• PSA:49.77
• LogP:0.46
• 旋光度49º(589NM,=1.3,CHCL3)
• 折射率1.484
• 蒸汽压0.0±1.3 mmHg at 25°C
• 溶解性Chloroform (Slightly), Methanol (Slightly)
• 敏感性按规定使用和贮存的不会分解，避氧化剂
• 外观形态白色至浅米色结晶粉末
• 储存条件置于阴暗处,密封, 常温干燥保存

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
  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.
• 防范说明P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
• UN编号NONH for all modes of transport
• 危险品标志Xi,Xn
• 安全声明26-36
• 危险类别码36/37/38-20/21/22
• WGK Germany3

欧盟法规

上下游产品

合成工艺路线路线简述

• 24424-99-5 + 68832-13-3 = 83435-58-9
  反应条件:1.1 Reagents: Triethylamine Solvents: Methanol; 30 Min,Rt -> Reflux
  标题:Synthesis,Radiolabeling,And In Vitro And In Vivo Evaluation Of [18F]Enl30: A Potential Pet Radiotracer For The 5-Ht7 Receptor
  作者:Tampio L'Estrade,Elina; Et Al
  参考文献:Acs Omega 日期:2019 卷标:4(4) 页码:7344-7353]
  
  24424-99-5 + 68832-13-3 = 83435-58-9
  反应条件:1.1 Solvents: Dichloromethane
  标题:Syntheses And Biological Evaluation Of Peptides Containing A Transition-State Isostere: The Chemistry Of Functionalized Sulfonamides In The Quest For Protease Inhibitors And Catalytic Antibodies
  作者:Moree,Willy Jantina
  参考文献:1994]
  
  = 83435-58-9
  反应条件:1.1 Reagents: Biphenyl Solvents: Methanol,Acetone; 15 Min,Rt; 24 H,Rt
  标题:Benzoyldiisopropylchlorosilane: A Visible Light Photocleavable Alcohol Protecting Group
  作者:Lind,Florian; Et Al
  参考文献:Chemical Science 日期:2023 卷标:14(44) 页码:12615-12620]
  
  37784-17-1 = 83435-58-9
  反应条件:1.1 Reagents: 4-Methylmorpholine,Isobutyl Chloroformate Solvents: Tetrahydrofuran1.2 Reagents: Iodine,Sodium Borohydride Solvents: Tetrahydrofuran
  标题:Endomorphin-1 Analogues Containing β-Proline Are μ-Opioid Receptor Agonists And Display Enhanced Enzymatic Hydrolysis Resistance
  作者:Cardillo,Giuliana; Et Al
  参考文献:Journal Of Medicinal Chemistry 日期:2002 卷标:45(12) 页码:2571-2578]
  
  1071494-85-3 = 83435-58-9
  反应条件:1.1 Reagents: Sodium Hydroxide Solvents: Tetrahydrofuran,Water; Rt -> 0 °C1.2 Reagents: Hydrogen Peroxide; 0 °C -> Reflux; 6.5 H,Reflux
  标题:The First Example Of Enamine-Lewis Acid Cooperative Bifunctional Catalysis: Application To The Asymmetric Aldol Reaction
  作者:Arnold,Kenny; Et Al
  参考文献:Chemical Communications (Cambridge 日期:2008 卷标:(33) 页码:3879-3881]
  
  24424-99-5 + 1110786-48-5 = 83435-58-9
  反应条件:1.1 Catalysts: Nadph,Magnesium Bromide,Alcohol Dehydrogenase Solvents: Isopropanol,Hexane; 18 H,Ph 9,30 °C1.2 Reagents: Triphenylphosphine,Water Solvents: Tetrahydrofuran; 24 H,Ph 9,Rt1.3 Reagents: Sodium Carbonate Solvents: Dichloromethane,Water; 12 H,Rt
  标题:Chemo- And Stereodivergent Preparation Of Terminal Epoxides And Bromohydrins Through One-Pot Biocatalysed Reactions: Access To Enantiopure Five- And Six-Membered N-Heterocycles
  作者:Bisogno,Fabricio R.; Et Al
  参考文献:Advanced Synthesis & Catalysis 日期:2010 卷标:352(10) 页码:1657-1661]
  
  344-25-2 = 83435-58-9 [标题:Reaction Conditions
  标题:Synthesis And Stereochemical Assignment Of Conioidine A: Dna- And Hsa-Binding Studies Of The Four Diastereomers
  作者:Shaktah,Ryan; Et Al
  参考文献:Journal Of Natural Products 日期:2020 卷标:83(10) 页码:3191-3198]
  
  344-25-2 = 83435-58-9
  反应条件:1.1 Reagents: Lithium Aluminum Hydride Solvents: Tetrahydrofuran2.1 -
  标题:Solvent Free,Fast And Asymmetric Michael Additions Of Ketones To Nitroolefins Using Chiral Pyrrolidine-Pyridone Conjugate Bases As Organocatalysts
  作者:Mahato,Chandan K.; Et Al
  参考文献:Tetrahedron: Asymmetry 日期:2017 卷标:28(4) 页码:511-515]
  
  1245539-83-6 = 83435-58-9
  反应条件:1.1 Reagents: Dess-Martin Periodinane Solvents: Dichloromethane; 1 H,Rt1.2 Reagents: Sodium Bicarbonate,Sodium Thiosulfate Solvents: Water; Rt2.1 Catalysts: Nadph,Magnesium Bromide,Alcohol Dehydrogenase Solvents: Isopropanol,Hexane; 18 H,Ph 9,30 °C2.2 Reagents: Triphenylphosphine,Water Solvents: Tetrahydrofuran; 24 H,Ph 9,Rt2.3 Reagents: Sodium Carbonate Solvents: Dichloromethane,Water; 12 H,Rt
  标题:Chemo- And Stereodivergent Preparation Of Terminal Epoxides And Bromohydrins Through One-Pot Biocatalysed Reactions: Access To Enantiopure Five- And Six-Membered N-Heterocycles
  作者:Bisogno,Fabricio R.; Et Al
  参考文献:Advanced Synthesis & Catalysis 日期:2010 卷标:352(10) 页码:1657-1661]
  
  145681-01-2 = 83435-58-9
  反应条件:1.1 Catalysts: Triacylglycerol Lipase Solvents: Water; 25 H,Ph 7.0,30 °C1.2 Reagents: Hydrochloric Acid Solvents: Water; Ph 2.5,30 °C2.1 Reagents: Lithium Chloride,Sodium Borohydride
  标题:Enzyme-Catalyzed Enantiomeric Resolution Of N-Boc-Proline As The Key-Step In An Expeditious Route Towards Ramp
  作者:Kurokawa,Masayuki; Et Al
  参考文献:Tetrahedron: Asymmetry 日期:2003 卷标:14(10) 页码:1323-1333]
  
  821-62-5 = 83435-58-9
  反应条件:1.1 Reagents: N-Bromosuccinimide,Ammonium Acetate Solvents: Acetone,Water; Overnight,Rt2.1 Reagents: Dess-Martin Periodinane Solvents: Dichloromethane; 1 H,Rt2.2 Reagents: Sodium Bicarbonate,Sodium Thiosulfate Solvents: Water; Rt3.1 Catalysts: Nadph,Magnesium Bromide,Alcohol Dehydrogenase Solvents: Isopropanol,Hexane; 18 H,Ph 9,30 °C3.2 Reagents: Triphenylphosphine,Water Solvents: Tetrahydrofuran; 24 H,Ph 9,Rt3.3 Reagents: Sodium Carbonate Solvents: Dichloromethane,Water; 12 H,Rt
  标题:Chemo- And Stereodivergent Preparation Of Terminal Epoxides And Bromohydrins Through One-Pot Biocatalysed Reactions: Access To Enantiopure Five- And Six-Membered N-Heterocycles
  作者:Bisogno,Fabricio R.; Et Al
  参考文献:Advanced Synthesis & Catalysis 日期:2010 卷标:352(10) 页码:1657-1661]
  
  = 83435-58-9
  反应条件:1.1 Reagents: Oxygen Catalysts: 2,3-Dichloro-5,6-Dicyano-1,4-Benzoquinone,Iron(Ii) Phthalocyanine,4,4′-Bipyridine Solvents: Toluene; 18 H,0.4 Mpa,80 °C
  标题:2,3-Dichloro-5,6-Dicyano-1,4-Benzoquinone-Catalyzed Aerobic Oxidation Reactions Via Multistep Electron Transfers With Iron(Ii) Phthalocyanine As An Electron-Transfer Mediator
  作者:Hong,Yiming; Et Al
  参考文献:Rsc Advances 日期:2016 卷标:6(57) 页码:51908-51913]
  
  24424-99-5 + 68832-13-3 = 83435-58-9
  反应条件:1.1 Reagents: Sodium Hydroxide Solvents: 1,4-Dioxane,Water
  标题:A Novel N-(Pyrrolidinyl-2-Methyl)Glycine-Based Pna With A Strong Preference For Rna Over Dna
  作者:Slaitas,Andis; Et Al
  参考文献:European Journal Of Organic Chemistry 日期:2002 卷标:(14) 页码:2391-2399]
  
  73323-65-6 = 83435-58-9
  反应条件:1.1 Reagents: Lithium Chloride,Sodium Borohydride
  标题:Enzyme-Catalyzed Enantiomeric Resolution Of N-Boc-Proline As The Key-Step In An Expeditious Route Towards Ramp
  作者:Kurokawa,Masayuki; Et Al
  参考文献:Tetrahedron: Asymmetry 日期:2003 卷标:14(10) 页码:1323-1333]
  
  73323-65-6 = 83435-58-9
  反应条件:1.1 Reagents: Lithium Aluminum Hydride Solvents: Tetrahydrofuran; 0 °C; 3 H,Rt1.2 Reagents: Sodium Hydroxide Solvents: Water; Rt
  标题:4,6-Disubstituted-1H-Indazole-4-Amine Derivatives With Immune-Chemotherapy Effect And In Vivo Antitumor Activity
  作者:Huo,Cui; Et Al
  参考文献:European Journal Of Medicinal Chemistry 日期:2022 卷标:241]
  
  37784-17-1 = 83435-58-9
  反应条件:1.1 Reagents: 4-Methylmorpholine,Pivaloyl Chloride1.2 Reagents: Sodium Borohydride
  标题:Synthesis And Biological Evaluation Of Potential 5-Ht7 Receptor Pet Radiotracers
  作者:Andries,Julien; Et Al
  参考文献:European Journal Of Medicinal Chemistry 日期:2011 卷标:46(8) 页码:3455-3461]
  
  37784-17-1 = 83435-58-9
  反应条件:1.1 Reagents: (T-4)-Trihydro(Tetrahydrofuran)Boron Solvents: Tetrahydrofuran; 0.5 H,4 - 7 °C; 15 H,4 - 7 °C
  标题:Synthesis And Evaluation Of In Vivo Anti-Hypothermic Effect Of All Stereoisomers Of The Thyrotropin-Releasing Hormone Mimetic: Rovatirelin Hydrate
  作者:Kobayashi,Naotake; Et Al
  参考文献:Journal Of Peptide Science 日期:2019 卷标:25(12)]
  
  344-25-2 = 83435-58-9
  反应条件:1.1 Reagents: Lithium Aluminum Hydride Solvents: Tetrahydrofuran; 3 H,70 °C2.1 Reagents: Sodium Bicarbonate Solvents: Tetrahydrofuran,Water; 16 H,Rt
  标题:Pyrrolidine-Oxadiazolone Conjugates As Organocatalysts In Asymmetric Michael Reaction
  作者:Mahato,Chandan K.; Et Al
  参考文献:Journal Of Organic Chemistry 日期:2019 卷标:84(2) 页码:1053-1063]
  
  149682-82-6 = 83435-58-9
  反应条件:1.1 Reagents: Butyllithium Solvents: Tetrahydrofuran; -78 °C; 1 H,-78 °C1.2 Reagents: Zinc Chloride Solvents: Diethyl Ether; -78 °C -> Rt; 16 H,Rt1.3 Reagents: Hydrochloric Acid Solvents: Water; Rt2.1 Reagents: Sodium Hydroxide Solvents: Tetrahydrofuran,Water; Rt -> 0 °C2.2 Reagents: Hydrogen Peroxide; 0 °C -> Reflux; 6.5 H,Reflux
  标题:The First Example Of Enamine-Lewis Acid Cooperative Bifunctional Catalysis: Application To The Asymmetric Aldol Reaction
  作者:Arnold,Kenny; Et Al
  参考文献:Chemical Communications (Cambridge 日期:2008 卷标:(33) 页码:3879-3881]
  
  24424-99-5 + 344-25-2 = 83435-58-9
  反应条件:1.1 Reagents: Triethylamine2.1 Reagents: 4-Methylmorpholine,Pivaloyl Chloride2.2 Reagents: Sodium Borohydride
  标题:Synthesis And Biological Evaluation Of Potential 5-Ht7 Receptor Pet Radiotracers
  作者:Andries,Julien; Et Al
  参考文献:European Journal Of Medicinal Chemistry 日期:2011 卷标:46(8) 页码:3455-3461]
  
  24424-99-5 + 43041-12-9 = 83435-58-9
  反应条件:1.1 Reagents: Triethylamine Catalysts: 4-(Dimethylamino)Pyridine Solvents: Dichloromethane; 1.5 H,Rt2.1 Reagents: Lithium Aluminum Hydride Solvents: Tetrahydrofuran; 0 °C; 3 H,Rt2.2 Reagents: Sodium Hydroxide Solvents: Water; Rt
  标题:4,6-Disubstituted-1H-Indazole-4-Amine Derivatives With Immune-Chemotherapy Effect And In Vivo Antitumor Activity
  作者:Huo,Cui; Et Al
  参考文献:European Journal Of Medicinal Chemistry 日期:2022 卷标:241]
  
  86953-79-9 + 83622-42-8 = 83435-58-9
  反应条件:1.1 Reagents: Sparteine,Sec-Butyllithium Solvents: Diethyl Ether,Cyclohexane; -78 °C; 10 Min,-78 °C1.2 Solvents: Diethyl Ether; -78 °C; 4.5 H,-78 °C1.3 Reagents: Zinc Chloride Solvents: Diethyl Ether; -78 °C; -78 °C -> Rt; 16 H,Rt1.4 Reagents: Hydrochloric Acid Solvents: Water; Rt2.1 Reagents: Sodium Hydroxide Solvents: Tetrahydrofuran,Water; Rt -> 0 °C2.2 Reagents: Hydrogen Peroxide; 0 °C -> Reflux; 6.5 H,Reflux
  标题:The First Example Of Enamine-Lewis Acid Cooperative Bifunctional Catalysis: Application To The Asymmetric Aldol Reaction
  作者:Arnold,Kenny; Et Al
  参考文献:Chemical Communications (Cambridge 日期:2008 卷标:(33) 页码:3879-3881]
  
  344-25-2 = 83435-58-9
  反应条件:1.1 Reagents: Thionyl Chloride Solvents: Methanol; 0 °C; 2 H,40 °C2.1 Reagents: Triethylamine Catalysts: 4-(Dimethylamino)Pyridine Solvents: Dichloromethane; 1.5 H,Rt3.1 Reagents: Lithium Aluminum Hydride Solvents: Tetrahydrofuran; 0 °C; 3 H,Rt3.2 Reagents: Sodium Hydroxide Solvents: Water; Rt
  标题:4,6-Disubstituted-1H-Indazole-4-Amine Derivatives With Immune-Chemotherapy Effect And In Vivo Antitumor Activity
  作者:Huo,Cui; Et Al
  参考文献:European Journal Of Medicinal Chemistry 日期:2022 卷标:241]
  
  59433-50-0 = 83435-58-9
  反应条件:1.1 Reagents: Potassium Carbonate Solvents: Dimethylformamide; 30 Min,Rt1.2 10 H,Rt2.1 Catalysts: Triacylglycerol Lipase Solvents: Water; 25 H,Ph 7.0,30 °C2.2 Reagents: Hydrochloric Acid Solvents: Water; Ph 2.5,30 °C3.1 Reagents: Lithium Chloride,Sodium Borohydride
  标题:Enzyme-Catalyzed Enantiomeric Resolution Of N-Boc-Proline As The Key-Step In An Expeditious Route Towards Ramp
  作者:Kurokawa,Masayuki; Et Al
  参考文献:Tetrahedron: Asymmetry 日期:2003 卷标:14(10) 页码:1323-1333]
  
  1119-51-3 = 83435-58-9
  反应条件:1.1 Reagents: Sodium Azide Solvents: Dimethylformamide; Rt2.1 Reagents: N-Bromosuccinimide,Ammonium Acetate Solvents: Acetone,Water; Overnight,Rt3.1 Reagents: Dess-Martin Periodinane Solvents: Dichloromethane; 1 H,Rt3.2 Reagents: Sodium Bicarbonate,Sodium Thiosulfate Solvents: Water; Rt4.1 Catalysts: Nadph,Magnesium Bromide,Alcohol Dehydrogenase Solvents: Isopropanol,Hexane; 18 H,Ph 9,30 °C4.2 Reagents: Triphenylphosphine,Water Solvents: Tetrahydrofuran; 24 H,Ph 9,Rt4.3 Reagents: Sodium Carbonate Solvents: Dichloromethane,Water; 12 H,Rt
  标题:Chemo- And Stereodivergent Preparation Of Terminal Epoxides And Bromohydrins Through One-Pot Biocatalysed Reactions: Access To Enantiopure Five- And Six-Membered N-Heterocycles
  作者:Bisogno,Fabricio R.; Et Al
  参考文献:Advanced Synthesis & Catalysis 日期:2010 卷标:352(10) 页码:1657-1661

海关参考信息

• 2905122000-异丙醇
  2905143000-叔丁醇
  2912110000-甲醛
  2915110000-甲酸
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• 详情请参考：📖 海关编码查询和海关进出口税则

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