CAS: 96-26-4; 1,3-Dihydroxyacetone

• 英文名称1,3-Dihydroxyacetone
• 中文名称1,3-二羟基丙酮
• IUPAC名称1,3-dihydroxypropan-2-one
• 其它别名Dihydroxyacetone (Usp); Dihydroxyacetone [usp]; 1,3-Dihydroxypropan-2-One; Dihydroxyacetone [vandf]; Oxantin; Alpha,Alpha'-Dihydroxyacetone; Triulose; Chr
• CAS编号96-26-4
• MFCD编号:MFCD00004670
• EINECS号:202-494-5
• FDA UNII编号:O10DDW6JOO
• 分子式:C3H6O3
• 分子量:90.08
• 产品CID: 2016850
• 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
• InChIKey: RXKJFZQQPQGTFL-UHFFFAOYSA-N
• InChI=1S/C3H6O3/c4-1-3(6)2-5/h4-5H,1-2H2…
• 计算化学: 氢键受体数3.0氢键供体数2可旋转键数2

相似化合物

物理性质

• 熔点75-80°C
• 沸点213.7°C at 760 mmHg
• 闪点97.3±16.9 °C
• 密度1.3±0.1 g/cm3
• PH:4-6 (20°C, 50g/L in H2O)
• pKa:12.45±0.10(预测)
• PSA:57.53
• LogP:-1.4599
• 折射率1.455
• 蒸汽压0.0±0.9 mmHg at 25°C
• 溶解性>112.4 mg/mL In DMSO; >5.09 mg/mL In Etoh With Ultrasonic
• 敏感性Stable. Combustible. Hygroscopic.
• 外观形态白色粉末
• 储存条件储存在 +2°C to +8°C.
• 产品应用该化合物用作皮肤湿润,自制(除非晒黑)和染发的化妆品成分;作为切除剂,防止皮肤湿度过度蒸发,提供紫外线保护;与皮肤氯丁酸氨基酸反应,生产棕色色色,模仿天然日光浴;作为合成心血管药物的制药中间体;作为食品添加剂和化学中间体使用;提高猪作为碳水化合物代谢代谢中间体的精肉百分比.

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P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
• UN编号OTH
• 危险品标志C
• 安全声明24/25
• 危险类别码36/37/38
• WGK Germany1

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 1,3-Dihydroxyacetone 主要起始原料 Glycerol
• 685-73-4 + 58-86-6 + 50-99-7 + 3458-28-4 + 6556-12-3 + 9034-32-6 + 57-48-7 = 96-26-4 + 78-98-8 + 67-47-0 + 144-62-7 + 50-21-5 + 123-76-2
  反应条件:1.1C:H2So4,S:H2O,1 H,100°C
  标题:Catalytic Transformation Of Biomass-Derived Hemicellulose Sugars By The One-Pot Method Into Oxalic,Lactic,And Levulinic Acids Using A Homogeneous H2So4 Catalyst
  作者:By Sobus,Natalia And Czekaj,Izabela
  参考文献:Catalysts 日期:2023 卷标:13(2) 页码:349]
  
  56-81-5 = 96-26-4 + 87-69-4 + 144-62-7 + 473-81-4 + 50-21-5
  反应条件:1.1R:O2,C:Pt,C:Ni,C:Zr,S:H2O,Rt -> 60°C; 6 H,60°C,10 Bar
  标题:Catalytic Oxidation Of Glycerol Over Pt Supported On Mof-Derived Carbon Nanosheets
  作者:By Ke,Yihu Et Al
  参考文献:Acs Omega 日期:2022 卷标:7(50) 页码:46452-46465]
  
  56-81-5 = 96-26-4
  反应条件:1.1 Reagents: Trichloroisocyanuric Acid Catalysts: Aluminum Trichloride Hexahydrate Solvents: Acetonitrile; 30 Min,Rt1.2 Solvents: Acetonitrile; 18 H,80 °C
  标题:An Efficient Chemical Conversion Of Glycerol To Dihydroxyacetone
  作者:Ulgheri,Fausta; Spanu,Pietro
  参考文献:Chemistryselect 日期:2018 卷标:3(41) 页码:11569-11572]
  
  56-81-5 = 96-26-4
  反应条件:1.1 Catalysts: Bismuth Oxide (Bi2O3),Chloroplatinic Acid Solvents: Water; 24 H
  标题:Photocatalytic Production Of 1,3-Dihydroxyacetone
  参考文献:Germany]
  
  = 96-26-4
  反应条件:1.1 Catalysts: Formolase (Synthetic Pseudomonas Fluorescens Strain Biovar-I) Solvents: Tetrahydrofuran,Water; 48 H,Ph 7,30 °C
  标题:Enantioselective Reductive Oligomerization Of Carbon Dioxide Into L-Erythrulose Via A Chemoenzymatic Catalysis
  作者:Desmons,Sarah; Grayson-Steel,Katie; Nunez-Dallos,Nelson; Vendier,Laure; Hurtado,John; Et Al
  参考文献:Journal Of The American Chemical Society 日期:2021 卷标:143(39) 页码:16274-16283]
  
  52941-82-9 = 96-26-4
  反应条件:1.1 Reagents: Hydrochloric Acid Solvents: Water; 2 H,40 °C
  标题:The Indirect Conversion Of Glycerol Into 1,3-Dihydroxyacetone Over Magnetic Polystyrene Nanosphere Immobilized Tempo Catalyst
  作者:Wang,Jianli; Zhang,Miao; Zheng,Zhi; Yu,Fengwen; Ji,Jianbing
  参考文献:Chemical Engineering Journal (Amsterdam 日期:2013 卷标:229 页码:234-238]
  
  52941-82-9 = 96-26-4
  反应条件:1.1 Reagents: Hydrochloric Acid Solvents: Water; 2 H,80 °C1.2 Reagents: Sodium Hydroxide Solvents: Water
  标题:Method For Synthesizing 1,3-Dihydroxyacetone By Indirect Oxidation Of Glycerol
  参考文献:China]
  
  56-81-5 = 96-26-4 [标题:Reaction Conditions
  标题:Fermentative Production Of Dihydroxyacetone
  参考文献:Japan]
  
  56-81-5 = 96-26-4
  反应条件:1.1 Reagents: Quinone Catalysts: Palladium(2+),Bis[μ-(Acetato-Ko:Ko′)]Bis(2,9-Dimethyl-1,10-Phenanthroline-Kn1,K... Solvents: Acetonitrile,Water; 4 H,23 °C
  标题:Selective Catalytic Oxidation Of Glycerol To Dihydroxyacetone
  作者:Painter,Ron M.; Pearson,David M.; Waymouth,Robert M.
  参考文献:Angewandte Chemie 日期:2010 卷标:49(49) 页码:9456-9459]
  
  56-81-5 = 96-26-4 + 80-69-3 + 144-62-7 + 473-81-4
  反应条件:1.1R:O2,C:Au,S:Meoh,8 H,140°C,30 Bar
  标题:Airborne Preparation Of Small Gold Nanoparticles Dispersed On Mesoporous Silica For The Catalytic Oxidation Of Glycerol To Dihydroxyacetone
  作者:By Van Der Verren,Margot Et Al
  参考文献:Acs Applied Nano Materials 日期:2022 卷标:5(12) 页码:18977-18985]
  
  56-81-5 = 96-26-4 + 80-69-3 + 56-82-6 + 144-62-7 + 473-81-4 + 50-21-5
  反应条件:1.1R:Ceo2,R:Koh,C:Pt,4 H,60°C
  标题:Tuning The Product Selectivity Toward The High Yield Of Glyceric Acid In Pt-Ceo2/cnt Electrocatalyzed Oxidation Of Glycerol
  作者:By Li,Jiefei Et Al
  参考文献:Chemcatchem 日期:2022 卷标:14(16) 页码:E202200509]
  
  1334317-30-4 = 96-26-4
  反应条件:1.1 Reagents: Methanol Solvents: Water; 30 Min,Ph 8 - 9,4 °C; 3 D,Rt
  标题:Exploratory Experiments On The Chemistry Of The "Glyoxylate Scenario": Formation Of Keto-Sugars From Dihydroxyfumarate
  作者:Sagi,Vasudeva Naidu; Punna,Venkateshwarlu; Hu,Fang; Meher,Geeta; Krishnamurthy,Ramanarayanan
  参考文献:Journal Of The American Chemical Society 日期:2012 卷标:134(7) 页码:3577-3589]
  
  56-81-5 = 96-26-4
  反应条件:1.1 Reagents: Trichloroisocyanuric Acid Catalysts: Aluminum Trichloride Hexahydrate Solvents: Acetonitrile; 18 H,Rt
  标题:Method For The Selective Oxidation Of Glycerol To Dihydroxyacetone
  参考文献:World Intellectual Property Organization]
  
  = 96-26-4
  反应条件:1.1 Reagents: Water Catalysts: Amberlyst 15; 10 Min,30 °C
  标题:A Novel Reactive Distillation Approach For Producing 1,3-Dihydroxyacetone From Glycerol
  作者:Hong,Xi; Lira,Carl T.; Miller,Dennis J.
  参考文献:Aiche Annual Meeting 日期:2011 卷标:641]
  
  56-81-5 = 96-26-4
  反应条件:1.1 Reagents: Nad Catalysts: Iron Oxide (Fe3O4),Silica,Dehydrogenase,Glycerol Solvents: Water; 60 Min,Ph 10,25 °C
  标题:Immobilization Of Glycerol Dehydrogenase On Magnetic Silica Nanoparticles For Conversion Of Glycerol To Value-Added 1,3-Dihydroxyacetone
  作者:Zheng,Muqing; Zhang,Songping
  参考文献:Biocatalysis And Biotransformation 日期:2011 卷标:29(6) 页码:278-287]
  
  56-82-6 = 96-26-4
  反应条件:1.1 Reagents: Water Catalysts: Hydroxylapatite (Ca5(Oh)(Po4)3); 85 °C
  标题:Efficient Ketose Production By A Hydroxyapatite Catalyst In A Continuous Flow Module
  作者:Usami,Kaho; Xiao,Kejing; Okamoto,Akimitsu
  参考文献:Acs Sustainable Chemistry & Engineering 日期:2019 卷标:7(3) 页码:3372-3377]
  
  52941-82-9 = 96-26-4
  反应条件:1.1 Reagents: Hydrochloric Acid Solvents: Water; 2 H,40 °C
  标题:Novel Process For 1,3-Dihydroxyacetone Production From Glycerol. 1. Technological Feasibility Study And Process Design
  作者:Zheng,Zhi; Luo,Min; Yu,Jianer; Wang,Jianli; Ji,Jianbing
  参考文献:Industrial & Engineering Chemistry Research 日期:2012 卷标:51(9) 页码:3715-3721]
  
  56-81-5 = 96-26-4
  反应条件:1.1 Catalysts: Tempo,Cu2+ (Alo(Oh)-Supported) Solvents: Acetonitrile,Water; 12 H,60 °C
  标题:Process For The Preparation Of Ketol Compounds
  参考文献:Japan]
  
  56-81-5 = 96-26-4
  反应条件:1.1 Reagents: Sodium Hydroxide Catalysts: Chloroauric Acid,Chloroplatinic Acid Solvents: Water; 2.5 H,Ph 12,60 °C1.2 Reagents: Sulfuric Acid Solvents: Water
  标题:Method For Selective Production Dihydroxyacetone From Glycerol As Well As Production A Metal Catalyst For Selective Oxidation Of Glycerol
  参考文献:Germany]
  
  = 96-26-4
  反应条件:1.1 Reagents: 5-Thiazoleethanol,4-Methyl-,Hydrochloride (1:1),Sodium Chloride,Polystyrene
  标题:Preparation Of 1,3-Dihydroxyacetone From Formaldehyde
  参考文献:Japan]
  
  = 96-26-4
  反应条件:1.1 Reagents: Disodium Phosphate Catalysts: 3-Ethyl-5-(2-Hydroxyethyl)-4-Methylthiazolium Bromide Solvents: Water
  标题:Preparation Of 1,3-Dihydroxyacetone
  参考文献:Japan]
  
  56-81-5 = 96-26-4 [标题:Reaction Conditions
  标题:Intensifying The Conversion Of Glycerol To Dihydroxyacetone By Acetobacter Suboxydans
  作者:Sattler,K.
  参考文献:Zeitschrift Fuer Allgemeine Mikrobiologie 日期:1965 卷标:5(2) 页码:136-46]
  
  56-81-5 = 96-26-4 [标题:Reaction Conditions
  标题:Studies On Aerobic Fermentation. Iv. Fermentative Production Of Dihydroxyacetone By Acetobacter Suboxydans Atcc 621
  作者:Yamada,Shigeki; Nabe,Koichi; Izuo,Nobuhiko; Wada,Mitsuru; Chibata,Ichiro
  参考文献:Journal Of Fermentation Technology 日期:1979 卷标:57(3) 页码:215-20]
  
  = 96-26-4
  反应条件:1.1 Catalysts: Diethylene Glycol Diethyl Ether,Triethylamine,Benzothiazolium,3-Hexadecyl-,Bromide (1:1) Solvents: Dimethylformamide
  标题:Preparation Of Dihydroxyacetone By Thiazolium Ylide Catalyzed Condensation Of Paraformaldehyde
  参考文献:Germany]
  
  56-81-5 = 96-26-4
  反应条件:1.1R:O2,C:9028-14-2,S:H2O,Ph 9.5
  标题:Aerobic Photobiocatalysis Enabled By Combining Core-Shell Nanophotoreactors And Native Enzymes
  作者:By Wei,Wenxin Et Al
  参考文献:Journal Of The American Chemical Society 日期:2022 卷标:144(16) 页码:7320-7326

海关参考信息

• 2905121000-正丙醇
  2905399001-1,3-丙二醇
  2912110000-甲醛
  2912120000-乙醛
• 💡 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

专利信息

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