Chelidonic Acid 白屈菜酸

CAS 99-32-1 MFCD00006577

化学结构图

99-32-1
SMILES: O=C(O)c1cc(=O)cc(C(=O)O)o1

化学属性

Mol. FormulaC7H4O6
Mol. Weight184.10
Melting Point265°C
Appearance 白色结晶性粉末。257℃分解。1g该品能溶于65ml水，26ml沸水，难溶于醇。
Boiling Point238.02 °C at 760 mmHg

别名和识别编码

Chemical NameChelidonic Acid
MDL NumberMFCD00006577
CAS Number99-32-1
Synonym Chelidonic acid {LY} Chelidonic acid {} {LY} Chelidonic acid {} {} {LY} Chelidonic acid {} {} {} {LY} Chelidonic acid {} {} {} {} {LY} Chelidonic acid {} {} {} {} {} {LY} Chelidonic acid {} {} {} {} {} {} {LY} Chelidonic acid {} {} {} {} {} {} {} {LY} Chelidonic acid {} {} {} {} {} {} {} {} {LY} Chelidonic acid {} {} {} {} {} {} {} {} {} {LY} Chelidonic acid {} {} {} {} {} {} {} {} {} {} {LY} Chelidonic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Chelidonic acid {} {} {} {} {} {} {} {} {} {} {} {} {LY} Chelidonic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Chelidonic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Chelidonic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Chelidonic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Chelidonic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Chelidonic acid {} {} {} {} {} {} {} {} {} {} {} {}
PubChem Substance ID7431
Beilstein Registry Number163607
EC Number202-749-0
Chemical Name Translation白屈菜酸
Merck Number13,2060
Wiswesser Line NotationT6O DVJ BVQ FVQ
LabNetwork Molecule IDLN00190278
InChIInChI=1S/C7H4O6/c8-3-1-4(6(9)10)13-5(2-3)7(11)12/h1-2H,(H,9,10)(H,11,12)
Canonical SMILESO=C(C1=CC(C=C(C(O)=O)O1)=O)O
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分类

  • {SNA} Berberis sp., Building Blocks, Chemical Synthesis, Heterocyclic Building Blocks, Nutrition Research, Phytochemicals by Plant (Food/Spice/Herb), Pyrans, 细胞生物学
  • {SNA} Berberis sp., Building Blocks, Chemical Synthesis, Heterocyclic Building Blocks, Nutrition Research, Phytochemicals by Plant (Food/Spice/Herb), Pyrans
  • {SNA} Berberis sp., Building Blocks, Chemical Synthesis, Heterocyclic Building Blocks, Phytochemicals by Plant (Food/Spice/Herb), Pyrans, 细胞生物学, 营养研究

安全信息

WGK Germany3
GHS Symbol
Precautionary statements
  • P261 Avoid breathing dust/fume/gas/mist/vapours/spray. 避免吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
  • P305+P351+P338
Hazard statements
  • H315 Causes skin irritation 会刺激皮肤
  • H319 Causes serious eye irritation 严重刺激眼睛
  • H335 May cause respiratory irritation 可能导致呼吸道刺激
RTECSUP7350000
Signal word Warning
Personal Protective Equipment dust mask type N95 (US), Eyeshields, Gloves
Safety Statements
  • S26 In case of contact with eyes, rinse immediately with plenty of water and seek medical advice 眼睛接触后，立即用大量水冲洗并征求医生意见；
  • S36 Wear suitable protective clothing 穿戴适当的防护服；
Hazard Codes Xi
Risk Statements
  • R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
TYPE OF TEST            : LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 500 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   CBCCT* "Summary Tables of Biological Tests," National Research Council
   Chemical-Biological Coordination Center.  (National Academy of Science
   Library, 2101 Constitution Ave., NW, Washington, DC 20418)
   Volume(issue)/page/year: 6,54,1954

Storage condition 2-8°C {LY} 2-8°C {} {LY} 2-8°C {} {} {LY} 2-8°C {} {} {} {LY} 2-8°C {} {} {} {} {LY} 2-8°C {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {}

其他信息

  • 用途一:用于有机合成。
  • 方法一:由草酸二乙酯和丙酮反应得到。
  • Sigma Aldrich:99-32-1(sigmaaldrich)
  • MOL 文件:99-32-1.mol
  • MSDS 信息:Chelidonic acid(99-32-1).msds
  • 上游原料:草酸二乙酯

系列性分类

  1. Life Science 生命科学
  2. Nutrition Research 营养研究
  3. Phytochemicals by Plant (Food/Spice/Herb) - Nutrition Research
  4. Berberis sp. - Phytochemicals by Plant (Food/Spice/Herb)
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Heterocyclic Building Blocks 杂环合成砌块
  4. Pyrans 派兰斯
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Heterocyclic Building Blocks 杂环合成砌块
  4. Pyrans 派兰斯

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