Hydroxyacetone 羟基丙酮

CAS 116-09-6 MFCD00004669

化学结构图

116-09-6
SMILES: CC(=O)CO

化学属性

Mol. FormulaC3H6O2
Mol. Weight74.08
Refractive index1.4200 to 1.4280
Boiling Point145-146 °C at 760 mmHg
Density1.082
Melting Point-17 °C
Flash Point57°C(lit.)
TSCAYes
Solubility溶于水、乙醇、乙醚
Stability对空气和湿度敏感
pH:A

别名和识别编码

Chemical NameHydroxyacetone
Synonym Hydroxyacetone {LY} Hydroxyacetone {} {LY} Hydroxyacetone {} {} {LY} Hydroxyacetone {} {} {} {LY} Hydroxyacetone {} {} {} {} {LY} Hydroxyacetone {} {} {} {} {} {LY} Hydroxyacetone {} {} {} {} {} {} {LY} Hydroxyacetone {} {} {} {} {} {} {} {LY} Hydroxyacetone {} {} {} {} {} {} {} {} {LY} Hydroxyacetone {} {} {} {} {} {} {} {} {} {LY} Hydroxyacetone {} {} {} {} {} {} {} {} {} {} {LY} Hydroxyacetone {} {} {} {} {} {} {} {} {} {} {} {LY} Hydroxyacetone {} {} {} {} {} {} {} {} {} {} {} {} {LY} Hydroxyacetone {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Hydroxyacetone {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Hydroxyacetone {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Hydroxyacetone {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Hydroxyacetone {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Hydroxyacetone {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {
CAS Number116-09-6
PubChem Substance ID8299
EC Number204-124-8
Beilstein Registry Number1,821
MDL NumberMFCD00004669
Reaxys-RN605368
Merck Number14,65
Chemical Name Translation羟基丙酮
Wiswesser Line NotationQ1V1
LabNetwork Molecule IDLN00223132
InChIInChI=1S/C3H6O2/c1-3(5)2-4/h4H,2H2,1H3
Canonical SMILESCC(CO)=O
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分类

  • {SNA} Certified Food Grade Products, E-H, Flavors and Fragrances, Kosher Certified Products
  • {uni_hamburg} no charge; ketone; alcohol; 1fragment
  • {SNA} Building Blocks, C3 to C6, Carbonyl Compounds, Chemical Synthesis, Ketones, Organic Building Blocks
  • Building Blocks, C3 to C6, Carbonyl Compounds, Chemical Synthesis, Ketones, Organic Building Blocks

产品应用

  • 有机合成中间体。

相关文献及参考

  • Short: II/25C
  • Acetol esters, formed by DCC coupling, have been employed as a means of carboxyl protection, stable to acid and hydrogenolysis, in peptide synthesis. They can be cleaved with TBAF in THF: Tetrahedron Lett., 33, 3193 (1992).
  • Short: II/14a

安全信息

GHS Symbol
WGK Germany1
Hazard statements
  • H226 Flammable liquid and vapour 易燃液体和蒸气
  • H250 Catches fire spontaneously if exposed to air 暴露于空气自发着火
Personal Protective Equipment Eyeshields, Gloves, half-mask respirator (US), multi-purpose combination respirator cartridge (US) Eyeshields, Gloves, half-mask respirator (EU), half-mask respirator (US), multi-purpose combination respirator cartridge (US)
RTECSUC2800000
Signal word
UN Number UN1224 1993
Precautionary statements
  • P210 Keep away from heat/sparks/open flames/hot surfaces. — No smoking. 远离热源/火花/明火/热的表面。——禁止吸烟。
  • P233 Keep container tightly closed. ?保持容器密闭。
  • P240 Ground/bond container and receiving equipment. 与地面接触/连接集装箱和接受设备。
  • P241 Use explosion-proof electrical/ventilating/lighting/…/equipment. 使用防爆电气/通风/照明/ .../设备。
  • P241+P242+P243
  • P242 Use only non-sparking tools. 只能使用无火花工具。
  • P243 Take precautionary measures against static discharge. 采取预防措施,防止静电放电。
  • P280 Wear protective gloves/protective clothing/eye protection/face protection. 戴防护手套/防护服/眼睛的保护物/面部保护物。
  • P303+P361+P353
  • P312 Call a POISON CENTER or doctor/physician if you feel unwell. 如果你感觉不适,呼叫解毒中心或医生/医师。
  • P370+P378
  • P403+P235
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
Storage condition 2-8°C, stored under nitrogen {LY} 2-8°C, stored under nitrogen Hygroscopic {} {LY} 2-8°C, stored under nitrogen {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored
Packing GroupIII
Safety Statements
Hazard Class3
Hazard Codes
Risk Statements
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 2200 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   JIHTAB Journal of Industrial Hygiene and Toxicology.  (Cambridge, MA)
   V.18-31, 1936-49.  For publisher information, see AEHLAU.
   Volume(issue)/page/year: 30,63,1948

TYPE OF TEST            : Mutation in microorganisms
TEST SYSTEM             : Bacteria - Salmonella typhimurium
DOSE/DURATION           : 500 ug/plate
REFERENCE :
   ABCHA6 Agricultural and Biological Chemistry.  (Maruzen Co. Ltd., POB 5050,
   Tokyo International, Tokyo 100-31, Japan)  V.25-    1961-
   Volume(issue)/page/year: 47,2461,1983

其他信息

  • 急性毒性:口服- 大鼠 LD50: 2200 毫克/ 公斤
  • 毒性分级:中毒
  • 羟基丙酮价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2011/04/16 H0388 羟基丙酮 Hydroxyacetone 500ML 1480元 2011/04/16 H0388 羟基丙酮 Hydroxyacetone 25ML 198元 2010/05/25 L15008 羟基丙酮, 95% Hydroxyacetone, 95% 500g 897元
  • 用途一:有机合成中间体。
  • TCI Shanghai:羟基丙酮 Hydroxyacetone,>;80.0%(GC)(116-09-6)
  • 溶于水、乙醇、乙醚。存在于啤酒、烟草、蜂密中。该品不稳定,可加甲醇使其稳定。
  • 图谱信息:羟基丙酮(116-09-6)核磁图( 1 HNMR) 羟基丙酮(116-09-6)红外图谱(IR1) 羟基丙酮(116-09-6)质谱(MS) 羟基丙酮(116-09-6)核磁图( 13 CNMR) 羟基丙酮(116-09-6)Raman光谱
  • 类别:易燃物品
  • 可燃性危险特性:可燃; 加热分解释放刺激烟雾
  • 下游产品:溶剂黄 114
  • 外观:无色至黄色液体.存在于破、烟草、蜂密中,不稳定,可加甲醇使其稳定。
  • 敏感性:Hygroscopic
  • 羟基丙酮价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 H0388 羟基丙酮 Hydroxyacetone 500ML 779元 2014/06/02 H0388 羟基丙酮 Hydroxyacetone 25ML 124元 2010/05/25 L15008 羟基丙酮, 95% Hydroxyacetone, 95% 500g 897元
  • MOL 文件:116-09-6.mol
  • 储运特性:库房通风低温干燥
  • 海关编码:29144090
  • Alfa Aesar:羟基丙酮,95% Hydroxyacetone, 95%(116-09-6)
  • 上游原料:甲醇 --> 甲醇溶液 --> 溴化钾 --> 溴丙酮 --> 甲酸钾
  • Sigma Aldrich:116-09-6(sigmaaldrich)
  • MSDS 信息:Acetol(116-09-6).msds
  • 灭火剂:干粉、泡沫、砂土、二氧化碳, 雾状水
  • 方法一:取氢氧化钾、无水甲醇及甲酸乙酯一起回流2h,制成甲酸钾的甲醇溶液。将其与溴丙酮加热回流,反应16h,反应毕冷却至0℃,滤除溴化钾,取滤液蒸馏,收集40-43℃(1.6kPa)馏分,得羟基丙酮,收率54-58%。

系列性分类


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