Calcium 4-Oxopentanoate 乙酰丙酸钙

CAS 591-64-0 MFCD00045959

化学结构图

591-64-0
SMILES: CC(=O)CCC(=O)[O-].CC(=O)CCC(=O)[O-].[Ca+2]

化学属性

Mol. FormulaC10H14CaO6
Mol. Weight270.29
Appearance #EndEditable "Content" 白色结晶或颗粒状粉末。熔点125℃。易溶于水，微溶于醇，不溶于醚和氯仿。微带焦糖气味，苦咸味，在真空室温干燥时失去1分子结晶水，在50℃时结晶水全部失去。 用途：用作营养药，治疗缺钙症。 制备方法：由糠醇经重排、水解、成盐而得。
Melting Point123 °C

别名和识别编码

Chemical NameCalcium 4-Oxopentanoate
MDL NumberMFCD00045959
CAS Number591-64-0
Synonym Calcium 4-oxopentanoate {LY} Calcium 4-oxopentanoate {} {LY} Calcium 4-oxopentanoate {} {} {LY} Calcium 4-oxopentanoate {} {} {} {LY} Calcium 4-oxopentanoate {} {} {} {} {LY} Calcium 4-oxopentanoate {} {} {} {} {} {LY} Calcium 4-oxopentanoate {} {} {} {} {} {} {LY} Calcium 4-oxopentanoate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Calcium 4-oxopentanoate {} {} {} {} {} {} {} {} {LY} Calcium 4-oxopentanoate {} {} {} {} {} {} {} {} {} {LY} Calcium 4-oxopentanoate {} {} {} {} {} {} {} {} {} {} {LY} Calcium 4-oxopentanoate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Calcium 4-oxopentanoate {} {} {} {} {} {} {} {} {} {} {} {} {LY} Calcium 4-oxopentanoate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Calcium 4-oxopentanoate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Calcium 4-oxopentanoate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Calcium 4-o
PubChem Substance ID11578
Beilstein Registry Number3764203
EC Number209-725-9
Reaxys-RN6301318
Merck Number1679
Chemical Name Translation乙酰丙酸钙
LabNetwork Molecule IDLN01742884
InChIInChI=1S/2C5H8O3.Ca/c2*1-4(6)2-3-5(7)8;/h2*2-3H2,1H3,(H,7,8);/q;;+2/p-2
Canonical SMILESCC(=O)CCC(=O)[O-].CC(=O)CCC(=O)[O-].[Ca+2]
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分类

  • {SNA} Analytical Standards, Chromatography, EP Standards, EP Standards C - D, Pharmaceutical Standards, Pharmacopeia Standards, 分析/色谱
  • {SA} Building Blocks, Carbonyl Compounds, Carboxylic Acid Salts, Chemical Synthesis, Organic Building Blocks
  • {SNA} Analytical Standards, Analytical/Chromatography, Chromatography, EP Standards, EP Standards C - D, Pharmaceutical Standards, Pharmacopeia Standards

安全信息

WGK Germany3
Personal Protective Equipment Eyeshields, Gloves, type N95 (US), type P1 (EN143) respirator filter
RTECSSA4000000 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 6140 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   FRPPAO Farmaco, Edizione Pratica. (Casella Postale 227, 27100 Pavia, Italy)
   V.8-43    1953-88 For publisher information, see FRMCE8
   Volume(issue)/page/year: 26,144,1971

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 7250 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   FRPPAO Farmaco, Edizione Pratica. (Casella Postale 227, 27100 Pavia, Italy)
   V.8-43    1953-88 For publisher information, see FRMCE8
   Volume(issue)/page/year: 26,144,1971

Storage condition 2-8°C, sealed storage, away from moisture {LY} 2-8°C, sealed storage, away from moisture {} {LY} 2-8°C, sealed storage, away from moisture {} {} {LY} 2-8°C, sealed storage, away from moisture {} {} {} {LY} 2-8°C, sealed storage, away from moisture {} {} {} {} {LY} 2-8°C, sealed storage, away from moisture {} {} {} {} {} {LY} 2-8°C, sealed storage, away from moisture {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, sealed storage, away from moisture {} {} {} {} {} {} {} {LY} 2-8°C, sealed storage, away from moisture {} {} {} {} {} {} {} {} {LY} 2-8°C, sealed storage, away from moisture {} {} {} {} {} {} {} {} {} {LY} 2-8°C, sealed storage, away from moisture {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, sealed storage, away from moisture {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, sealed storage, away from moisture {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, sealed storage, away from moisture {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, sealed storage, away f

其他信息

  • TCI Shanghai:乙酰丙酸钙二水合物 Calcium Levulinate Dihydrate,>;98.0%(T)(591-64-0)
  • 方法一:由糠醇经重排、水解、成盐而得。 用途：用作营养药，治疗缺钙症。 #EndEditable "Content"
  • 上游原料:糠醇
  • 图谱信息:乙酰丙酸钙(591-64-0)红外图谱(IR2) 乙酰丙酸钙(591-64-0)红外图谱(IR1)
  • MOL 文件:591-64-0.mol
  • 乙酰丙酸钙价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 L0043 乙酰丙酸钙二水合物 Calcium Levulinate Dihydrate 25G 1240元
  • 用途一:用作营养药，治疗缺钙症。 #EndEditable "Content"

系列性分类

  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Chemicals by Class 化学分类法
  4. Metal Compounds 金属化合物

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