2-酮丁酸
| 中文名称 | 2-酮丁酸 |
|---|---|
| 中文同义词 | 2-丁酮酸;3-甲基丙酮酸;2-氧带丁酸;2-氧代丁酸;2-酮丁酸;2-丁酮酸/2-酮丁酸;2-酮丁酸 5G;2-丁酮酸(怕热+4℃) |
| 英文名称 | 2-Oxobutyric acid |
| 英文同义词 | PROPIONYLFORMIC ACID;2-Ketobutanoic acid;2-oxo-butanoicaci;alpha-Ketobutric acid;alpha-Oxobutyrate;alpha-Oxo-n-butyric acid;Butanoicacid,2-oxo-;Butyric acid, 2-oxo- |
| CAS号 | 600-18-0 |
| 分子式 | C4H6O3 |
| 分子量 | 102.09 |
| EINECS号 | 209-986-9 |
| 相关类别 | 医用原料;有机砌块;化学试剂;羧酸;通用试剂;医药原料;食品添加;生化试剂-其他化学试剂;体外诊断试剂;诊断试剂系列-诊断试剂系列;Pharmaceutical Raw Materials;Aliphatics;Enzyme substrates;食品添加剂-食品原料;通用生化试剂-有机酸 |
| Mol文件 | 600-18-0.mol |
| 结构式 | ![]() |
2-酮丁酸 性质
| 熔点 | 30-34 °C(lit.) |
|---|---|
| 沸点 | 84 °C20 mm Hg(lit.) |
| 密度 | 1.2000 |
| FEMA | 3723 | 2-OXOBUTYRIC ACID |
| 折射率 | 1.3972 (estimate) |
| 闪点 | 179 °F |
| 储存条件 | Store at +2°C to +8°C. |
| 溶解度 | H2O:0.1g/mL,clear |
| 酸度系数(pKa) | 2.5(at 25℃) |
| 形态 | 液体 |
| 颜色 | 白色到近乎白色 |
| 比重 | 1.3972 (20/4℃) |
| PH值 | 3.11(1 mM solution);2.38(10 mM solution);1.79(100 mM solution); |
| 气味 (Odor) | 1.00% 的丙二醇溶液。焦糖奶油味 |
| 香型 | caramellic |
| 生物来源 | synthetic |
| JECFA Number | 589 |
| BRN | 1700514 |
| 主要应用 | cleaning products cosmetics food and beverages personal care |
| InChI | 1S/C4H6O3/c1-2-3(5)4(6)7/h2H2,1H3,(H,6,7) |
| InChIKey | TYEYBOSBBBHJIV-UHFFFAOYSA-N |
| SMILES | CCC(C(O)=O)=O |
| LogP | -0.75 |
| CAS 数据库 | 600-18-0(CAS DataBase Reference) |
| NIST化学物质信息 | Butanoic acid, 2-oxo-(600-18-0) |
| EPA化学物质信息 | 2-Oxobutyric acid (600-18-0) |
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Human Endogenous Metabolite
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2-Oxobutanoic acid (alpha-Ketobutyric acid) is a product in the enzymatic cleavage of cystathionine. 2-Oxobutanoic acid is a substance that is involved in the metabolism of many amino acids as well as propanoate metabolism and C-5 branched dibasic acid metabolism. 2-Oxobutanoic acid is also one of the degradation products of threonine. It can be converted into propionyl-CoA (and subsequently methylmalonyl CoA, which can be converted into succinyl CoA, a citric acid cycle intermediate), and thus enter the citric acid cycle.
安全信息
| 危险品标志 | Xi |
|---|---|
| 危险类别码 | 36/37/38 |
| 安全说明 | 26-36/37/39-36 |
| 危险品运输编号 | 1759 |
| WGK Germany | 3 |
| TSCA | TSCA listed |
| 危险等级 | 8 |
| 包装类别 | III |
| 海关编码 | 29183000 |
| 存储类别 | 8A - 可燃,腐蚀性物质 |
| 危险性类别 | 严重眼损伤 类别1 皮肤腐蚀 类别1B |
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