CAS: 77-86-1; 2-Amino-2-(Hydroxymethyl)Propane-1,3-Diol

• 英文名称2-Amino-2-(Hydroxymethyl)Propane-1,3-Diol
• 中文名称三(羟甲基)氨基甲烷(Tris)
• IUPAC名称2-amino-2-(hydroxymethyl)propane-1,3-diol
• 其它别名Tris; Triladyl; Tris-Hydroxymethyl-Aminomethan [german]; Trometamole; Trometamolum; Tromethamine (Ii); (Tris(Hydroxymethyl)Aminomethane); Tham-E; Tris-Amine; 1,1,1-Tris(Hydroxymethyl)Methanamine; Tromethamine; Trometamol; 2-Amino-2-
• CAS编号77-86-1
• MFCD编号:MFCD00004679
• EINECS号:201-064-4
• 分子式:C4H11NO3
• 分子量:121.14
• 产品CID: 1773542
• 产品分类有机原料→分子砌块→脂肪链类化合物

• 相似结构搜索
• 产品信息参考;;;
• InChIKey: LENZDBCJOHFCAS-UHFFFAOYSA-N
• InChI=1S/C4H11NO3/c5-4(1-6,2-7)3-8/h6-8H,1-3,5H2…
• 计算化学: 氢键受体数4.0氢键供体数4.0可旋转键数3.0

相似化合物

物理性质

• 熔点167-172°C
• 沸点219-220 °C at 10 mmHg
• 闪点169.7±26.5 °C
• 密度1.3±0.1 g/cm3
• PH:10.5-12.0(4 m in water, 25 °C)
• pKa:8.1(at 25°C)
• PSA:86.71
• LogP:-2.3392
• 折射率1.544
• 蒸汽压0.0±1.8 mmHg at 25°C
• 溶解性水: 4 M At 20 °c, Clear, Colorless
• 敏感性吸潮
• 外观形态白色结晶
• 储存条件20-25°C
• 产品应用磷霉素的中间体,亦可作硫化促进剂,化妆品(霜剂,洗剂),矿物油,石蜡乳化剂,生物学缓冲剂.
• 性质描述白色结晶或粉末.熔点171-172°C,沸点219-220°C/1.3kPa,溶于乙醇和水,微溶于乙酸乙酯,苯,不溶于乙醚,四氯化碳,对铜,铝有腐蚀作用,有刺激性.

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
  急性毒性 类别4(吸入)
  急性毒性 类别4(经皮)
  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.
  H336 |可能引起嗜睡或头晕.
  H332 |吸入有害.
  H312 |皮肤接触有害.
• 防范说明P261-P264-P271-P280-P302+P352-P305+P351+P338
• 危险等级IRRITANT
• UN编号NONH for all modes of transport
• 危险品标志Xi
• 安全声明26-36-37/39-24/25-23
• 危险类别码36/37/38
• WGK Germany2

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 Tris(Hydroxymethyl)Aminomethane 主要起始原料 Acrylamide
• 77-86-1 + 864953-38-8 = 77-86-1 + 864953-29-7
  反应条件:1.1 Catalysts: Acetic Acid Solvents: Acetone,Water; Rt -> 34 °C; 11 H,34 °C; 34 °C -> 20 °C; 0.5 - 1.5 H,20 °C
  标题:Preparation Of The Hiv Attachment Inhibitor Bms-663068. Part 9. Active Pharmaceutical Ingredient Process Development And Powder Properties
  作者:La Cruz,Thomas E.; Et Al
  参考文献:Organic Process Research & Development 日期:2017 卷标:21(8) 页码:1174-1185]
  
  229625-50-7 + 1449413-05-1 + 7758-02-3 = 77-86-1 + 864953-29-7
  反应条件:1.1 Reagents: Tripotassium Phosphate Catalysts: Tetraethylammonium Iodide Solvents: Acetonitrile; 45 °C2.1 Reagents: Acetic Acid Solvents: Acetone,Water; 35 °C
  标题:Preparation Of The Hiv Attachment Inhibitor Bms-663068. Part 2. Strategic Selections In The Transition From An Enabling Route To A Commercial Synthesis
  作者:Chen,Ke; Et Al
  参考文献:Organic Process Research & Development 日期:2017 卷标:21(8) 页码:1110-1121]
  
  229625-50-7 + 1449413-05-1 + 7758-02-3 = 77-86-1 + 864953-29-7
  反应条件:1.1 Reagents: Tetraethylammonium Iodide,Tripotassium Phosphate Solvents: Acetonitrile,Dichloromethane; 21 H,40 - 45 °C2.1 Solvents: Acetone,Water
  标题:Synthesis Of The 6-Azaindole Containing Hiv-1 Attachment Inhibitor Pro-Drug,Bms-663068
  作者:Chen,Ke; Et Al
  参考文献:Journal Of Organic Chemistry 日期:2014 卷标:79(18) 页码:8757-8767]
  
  56227-55-5 + 1627137-24-9 = 77-86-1 + 864953-29-7
  反应条件:1.1 Reagents: 1,1′-Carbonyldiimidazole Solvents: Dimethylformamide; Rt -> 10 °C; 3 H,10 °C1.2 10 °C; 2 H,10 °C -> 25 °C1.3 Solvents: Water; 25 °C -> 40 °C2.1 Reagents: Potassium Hydroxide Catalysts: Trans-N,N′-Dimethyl-1,2-Cyclohexanediamine Solvents: Acetonitrile,Water; 1 H,20 °C2.2 Catalysts: Cuprous Iodide; 18 H,20 °C -> 75 °C3.1 Reagents: Tetraethylammonium Iodide,Tripotassium Phosphate Solvents: Acetonitrile,Dichloromethane; 21 H,40 - 45 °C4.1 Solvents: Acetone,Water
  标题:Synthesis Of The 6-Azaindole Containing Hiv-1 Attachment Inhibitor Pro-Drug,Bms-663068
  作者:Chen,Ke; Et Al
  参考文献:Journal Of Organic Chemistry 日期:2014 卷标:79(18) 页码:8757-8767]
  
  5781-53-3 = 77-86-1 + 864953-29-7
  反应条件:1.1 Reagents: Aluminum Chloride Solvents: Dichloromethane,Nitromethane; 20 Min,0 °C1.2 5 H,0 °C1.3 Reagents: Sodium Hydroxide Solvents: Water1.4 Reagents: Hydrogen Bromide Solvents: Water; 45 °C; 3 H,45 °C -> 21 °C2.1 Reagents: 1,1′-Carbonyldiimidazole Solvents: Dimethylformamide; Rt -> 10 °C; 3 H,10 °C2.2 10 °C; 2 H,10 °C -> 25 °C2.3 Solvents: Water; 25 °C -> 40 °C3.1 Reagents: Potassium Hydroxide Catalysts: Trans-N,N′-Dimethyl-1,2-Cyclohexanediamine Solvents: Acetonitrile,Water; 1 H,20 °C3.2 Catalysts: Cuprous Iodide; 18 H,20 °C -> 75 °C4.1 Reagents: Tetraethylammonium Iodide,Tripotassium Phosphate Solvents: Acetonitrile,Dichloromethane; 21 H,40 - 45 °C5.1 Solvents: Acetone,Water
  标题:Synthesis Of The 6-Azaindole Containing Hiv-1 Attachment Inhibitor Pro-Drug,Bms-663068
  作者:Chen,Ke; Et Al
  参考文献:Journal Of Organic Chemistry 日期:2014 卷标:79(18) 页码:8757-8767]
  
  619331-35-0 + 5781-53-3 = 77-86-1 + 864953-29-7
  反应条件:1.1 Reagents: Aluminum Chloride Solvents: Dichloromethane,Nitromethane; 0 °C1.2 Reagents: Sodium Hydroxide Solvents: Water; 20 °C2.1 Reagents: 1,1′-Carbonyldiimidazole Solvents: Acetonitrile3.1 Reagents: Potassium Hydroxide,Trans-N,N′-Dimethyl-1,2-Cyclohexanediamine Catalysts: Cuprous Iodide Solvents: Acetonitrile,Water; 12 H,78 °C3.2 Reagents: Lithium Bromide4.1 Reagents: Tripotassium Phosphate Catalysts: Tetraethylammonium Iodide Solvents: Acetonitrile; 45 °C5.1 Reagents: Acetic Acid Solvents: Acetone,Water; 35 °C
  标题:Preparation Of The Hiv Attachment Inhibitor Bms-663068. Part 2. Strategic Selections In The Transition From An Enabling Route To A Commercial Synthesis
  作者:Chen,Ke; Et Al
  参考文献:Organic Process Research & Development 日期:2017 卷标:21(8) 页码:1110-1121]
  
  23155-02-4 + 77-86-1 + 618-36-0 = 77-86-1 + 23155-02-4 [标题:Reaction Conditions
  标题:Process For Synthesizing Phosphonomycin Monotrometamol Salt
  参考文献:China]
  
  77-86-1 + 864953-38-8 = 77-86-1 + 864953-29-7
  反应条件:1.1 Reagents: Acetic Acid Solvents: Acetone,Water; 35 °C
  标题:Preparation Of The Hiv Attachment Inhibitor Bms-663068. Part 2. Strategic Selections In The Transition From An Enabling Route To A Commercial Synthesis
  作者:Chen,Ke; Et Al
  参考文献:Organic Process Research & Development 日期:2017 卷标:21(8) 页码:1110-1121]
  
  77-86-1 + 864953-38-8 = 77-86-1 + 864953-29-7
  反应条件:1.1 Solvents: Acetone,Water
  标题:Synthesis Of The 6-Azaindole Containing Hiv-1 Attachment Inhibitor Pro-Drug,Bms-663068
  作者:Chen,Ke; Et Al
  参考文献:Journal Of Organic Chemistry 日期:2014 卷标:79(18) 页码:8757-8767]
  
  = 77-86-1 + 864953-29-7
  反应条件:1.1 Reagents: Lithium Bromide2.1 Reagents: Tripotassium Phosphate Catalysts: Tetraethylammonium Iodide Solvents: Acetonitrile; 45 °C3.1 Reagents: Acetic Acid Solvents: Acetone,Water; 35 °C
  标题:Preparation Of The Hiv Attachment Inhibitor Bms-663068. Part 2. Strategic Selections In The Transition From An Enabling Route To A Commercial Synthesis
  作者:Chen,Ke; Et Al
  参考文献:Organic Process Research & Development 日期:2017 卷标:21(8) 页码:1110-1121]
  
  7170-01-6 + 1449413-23-3 = 77-86-1 + 864953-29-7
  反应条件:1.1 Reagents: Potassium Hydroxide,Trans-N,N′-Dimethyl-1,2-Cyclohexanediamine Catalysts: Cuprous Iodide Solvents: Acetonitrile,Water; 12 H,78 °C1.2 Reagents: Lithium Bromide2.1 Reagents: Tripotassium Phosphate Catalysts: Tetraethylammonium Iodide Solvents: Acetonitrile; 45 °C3.1 Reagents: Acetic Acid Solvents: Acetone,Water; 35 °C
  标题:Preparation Of The Hiv Attachment Inhibitor Bms-663068. Part 2. Strategic Selections In The Transition From An Enabling Route To A Commercial Synthesis
  作者:Chen,Ke; Et Al
  参考文献:Organic Process Research & Development 日期:2017 卷标:21(8) 页码:1110-1121]
  
  593-71-5 + 33494-80-3 = 77-86-1 + 864953-29-7
  反应条件:1.1 Reagents: Chlorosulfonic Acid1.2 -2.1 Reagents: Tripotassium Phosphate Catalysts: Tetraethylammonium Iodide Solvents: Acetonitrile; 45 °C3.1 Reagents: Acetic Acid Solvents: Acetone,Water; 35 °C
  标题:Preparation Of The Hiv Attachment Inhibitor Bms-663068. Part 2. Strategic Selections In The Transition From An Enabling Route To A Commercial Synthesis
  作者:Chen,Ke; Et Al
  参考文献:Organic Process Research & Development 日期:2017 卷标:21(8) 页码:1110-1121]
  
  13754-38-6 + 954215-12-4 = 77-86-1 + 864953-29-7
  反应条件:1.1 Reagents: 1,1′-Carbonyldiimidazole Solvents: Acetonitrile2.1 Reagents: Potassium Hydroxide,Trans-N,N′-Dimethyl-1,2-Cyclohexanediamine Catalysts: Cuprous Iodide Solvents: Acetonitrile,Water; 12 H,78 °C2.2 Reagents: Lithium Bromide3.1 Reagents: Tripotassium Phosphate Catalysts: Tetraethylammonium Iodide Solvents: Acetonitrile; 45 °C4.1 Reagents: Acetic Acid Solvents: Acetone,Water; 35 °C
  标题:Preparation Of The Hiv Attachment Inhibitor Bms-663068. Part 2. Strategic Selections In The Transition From An Enabling Route To A Commercial Synthesis
  作者:Chen,Ke; Et Al
  参考文献:Organic Process Research & Development 日期:2017 卷标:21(8) 页码:1110-1121]
  
  = 77-86-1 + 864953-29-7
  反应条件:1.1 Reagents: Potassium Iodide,Phosphorus Trichloride,Hydrogen Peroxide1.2 -2.1 Reagents: Chlorosulfonic Acid2.2 -3.1 Reagents: Tripotassium Phosphate Catalysts: Tetraethylammonium Iodide Solvents: Acetonitrile; 45 °C4.1 Reagents: Acetic Acid Solvents: Acetone,Water; 35 °C
  标题:Preparation Of The Hiv Attachment Inhibitor Bms-663068. Part 2. Strategic Selections In The Transition From An Enabling Route To A Commercial Synthesis
  作者:Chen,Ke; Et Al
  参考文献:Organic Process Research & Development 日期:2017 卷标:21(8) 页码:1110-1121]
  
  1421517-98-7 = 77-86-1 + 864953-29-7
  反应条件:1.1 Reagents: Tripotassium Phosphate,Phosphorus(1+),Bromotri-1-Pyrrolidinyl-,(T-4)-,Hexafluorophosphate(1-) (1:1) Solvents: (Trifluoromethyl)Benzene; 3 H,20 °C; 2 H,50 °C1.2 Reagents: Sodium Hydroxide Solvents: Isopropanol; 80 °C2.1 Reagents: Aluminum Chloride Solvents: Dichloromethane,Nitromethane; 0 °C2.2 Reagents: Sodium Hydroxide Solvents: Water; 20 °C3.1 Reagents: 1,1′-Carbonyldiimidazole Solvents: Acetonitrile4.1 Reagents: Potassium Hydroxide,Trans-N,N′-Dimethyl-1,2-Cyclohexanediamine Catalysts: Cuprous Iodide Solvents: Acetonitrile,Water; 12 H,78 °C4.2 Reagents: Lithium Bromide5.1 Reagents: Tripotassium Phosphate Catalysts: Tetraethylammonium Iodide Solvents: Acetonitrile; 45 °C6.1 Reagents: Acetic Acid Solvents: Acetone,Water; 35 °C
  标题:Preparation Of The Hiv Attachment Inhibitor Bms-663068. Part 2. Strategic Selections In The Transition From An Enabling Route To A Commercial Synthesis
  作者:Chen,Ke; Et Al
  参考文献:Organic Process Research & Development 日期:2017 卷标:21(8) 页码:1110-1121]
  
  1627136-94-0 = 77-86-1 + 864953-29-7
  反应条件:1.1 Reagents: Cumene Hydroperoxide,Methanesulfonyl Chloride Solvents: Methanol; 2 H,30 °C; 30 °C -> 20 °C1.2 Reagents: Triethylamine; 30 Min,20 °C1.3 Reagents: Sodium Thiosulfate Solvents: Water; 2 H,20 °C2.1 Reagents: Hydrogen Peroxide Catalysts: Methyltrioxorhenium Solvents: Dichloromethane,Water; 24 H,25 °C; 25 °C -> 0 °C2.2 Reagents: Disodium Sulfide Solvents: Water; 0 °C2.3 Reagents: Tripotassium Phosphate,Phosphorus(1+),Bromotri-1-Pyrrolidinyl-,(T-4)-,Hexafluorophosphate(1-) (1:1) Solvents: (Trifluoromethyl)Benzene; 3 H,20 °C; 20 °C -> 50 °C; 2 H,50 °C2.4 Reagents: Sodium Hydroxide Solvents: Isopropanol; 50 °C -> 80 °C; 12 H,80 °C2.5 Reagents: Hydrochloric Acid Solvents: Isopropanol; 30 Min,50 °C; 2 H,50 °C -> 5 °C3.1 Reagents: Aluminum Chloride Solvents: Dichloromethane,Nitromethane; 20 Min,0 °C3.2 5 H,0 °C3.3 Reagents: Sodium Hydroxide Solvents: Water3.4 Reagents: Hydrogen Bromide Solvents: Water; 45 °C; 3 H,45 °C -> 21 °C4.1 Reagents: 1,1′-Carbonyldiimidazole Solvents: Dimethylformamide; Rt -> 10 °C; 3 H,10 °C4.2 10 °C; 2 H,10 °C -> 25 °C4.3 Solvents: Water; 25 °C -> 40 °C5.1 Reagents: Potassium Hydroxide Catalysts: Trans-N,N′-Dimethyl-1,2-Cyclohexanediamine Solvents: Acetonitrile,Water; 1 H,20 °C5.2 Catalysts: Cuprous Iodide; 18 H,20 °C -> 75 °C6.1 Reagents: Tetraethylammonium Iodide,Tripotassium Phosphate Solvents: Acetonitrile,Dichloromethane; 21 H,40 - 45 °C7.1 Solvents: Acetone,Water
  标题:Synthesis Of The 6-Azaindole Containing Hiv-1 Attachment Inhibitor Pro-Drug,Bms-663068
  作者:Chen,Ke; Et Al
  参考文献:Journal Of Organic Chemistry 日期:2014 卷标:79(18) 页码:8757-8767

海关参考信息

• 2905121000-正丙醇
  2905399001-1,3-丙二醇
  2922110001-单乙醇胺
  2905141000-异丁醇
• 💡 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

其他信息查阅

• ➥ 象形图和危险代码
• ➥ 防范代码详解
• ➥ 危险代码说明
• ➥ Globally Harmonized System
• ➥ REACH监管