Ethyl 3-(3,4-dimethoxyphenyl)-3-oxopropanoate 3,4-二甲氧基苯甲酰乙酸乙酯

CAS 4687-37-0 MFCD03424826

化学结构图

4687-37-0
SMILES: CCOC(=O)CC(=O)c1ccc(OC)c(OC)c1

化学属性

Mol. FormulaC13H16O5
Mol. Weight252.26
Melting Point37-41°C
Flash Point>110°C
Boiling Point350.9°C at 760 mmHg

别名和识别编码

Chemical NameEthyl 3-(3,4-dimethoxyphenyl)-3-oxopropanoate
Synonym Ethyl 3-oxo-3-(3,4-dimethoxyphenyl)propanoate {LY} Ethyl 3-oxo-3-(3,4-dimethoxyphenyl)propanoate {} {LY} Ethyl 3-oxo-3-(3,4-dimethoxyphenyl)propanoate {} {} {LY} Ethyl 3-oxo-3-(3,4-dimethoxyphenyl)propanoate {} {} {} {LY} Ethyl 3-oxo-3-(3,4-dimethoxyphenyl)propanoate {} {} {} {} {LY} Ethyl 3-oxo-3-(3,4-dimethoxyphenyl)propanoate {} {} {} {} {} {LY} Ethyl 3-oxo-3-(3,4-dimethoxyphenyl)propanoate {} {} {} {} {} {} {LY} Ethyl 3-oxo-3-(3,4-dimethoxyphenyl)propanoate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Ethyl 3-oxo-3-(3,4-dimethoxyphenyl)propanoate {} {} {} {} {} {} {} {} {LY} Ethyl 3-oxo-3-(3,4-dimethoxyphenyl)propanoate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Ethyl 3-oxo-3-(3,4-dimethoxyphenyl)propanoate {} {} {} {} {} {} {} {} {} {} {LY} Ethyl 3-oxo-3-(3,4-dimethoxyphenyl)propanoate {} {} {} {} {} {} {} {} {} {} {} {LY} Ethyl 3-oxo-3-(3,4-dimethoxyphenyl)propanoate {} {} {} {} {} {} {} {} {} {} {} {} {LY} Ethyl 3-oxo-3-(3,4-dimethoxypheny
MDL NumberMFCD03424826
CAS Number4687-37-0
PubChem Substance ID2758465
Chemical Name Translation3,4-二甲氧基苯甲酰乙酸乙酯
LabNetwork Molecule IDLN00338729
InChIInChI=1S/C13H16O5/c1-4-18-13(15)8-10(14)9-5-6-11(16-2)12(7-9)17-3/h5-7H,4,8H2,1-3H3
Canonical SMILESO=C(OCC)CC(C1=CC=C(OC)C(OC)=C1)=O
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分类

  • {uni_hamburg} no charge; carbocycle; aromatic; 6RingOnly; 6ring; ester; ketone; ether; 1fragment
  • {SNA} Building Blocks, C12 to C63, Carbonyl Compounds, Chemical Synthesis, Esters, Organic Building Blocks

相关文献及参考

  • Short: III/35C1 Title: Nuclear Magnetic Resonance (NMR) Data: Chemical Shifts and Coupling Constants for Hydrogen-1, Part 1: Aliphatic and Aromatic Hydrocarbons, Steroids, Carbohydrates Author: Gupta, R.R.; Jain, M. Editor: Gupta, R.R.; Lechner, M.D. Source: Landolt-Börnstein, New Series Volume: III/35C1 Year: 2000 ISBN: 3-540-66780-6 ISBN: 978-3-540-66780-3 Internet Resource: DOI:10.1007/b60149 RefComment: VII, 310 pages. With CD-ROM. Hardcover Abstract: This volume provides a comprehensive and evaluated compilation of nuclear magnetic resonance data. Chemical shifts and coupling constants of boron-11 and phosphorus-31 (subvol. A), fluorine-19 and nitrogen-15 (subvol. B), hydrogen-1 (subvol. C), and carbon-13 (subvol. D) compounds are tabulated together with the gross- and structure formulas and the most readily available solvents. Due to the large amount of the data merely chemical shifts are presented in the printed versions, and all the data, chemical shifts and coupling constants are provided on CD-ROM's.

安全信息

WGK Germany3
GHS Symbol
Signal word Warning
Hazard statements
  • H302 Harmful if swallowed 吞食有害
Personal Protective Equipment dust mask type N95 (US), Eyeshields, Gloves
Safety Statements
  • S36 Wear suitable protective clothing 穿戴适当的防护服；
Hazard Codes Xn
Risk Statements
  • R22 Harmful if swallowed 吞咽有害
Storage condition Store at room temperature {LY} Store at room temperature {} {LY} Store at room temperature {} {} {LY} Store at room temperature {} {} {} {LY} Store at room temperature {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {}

其他信息

  • Sigma Aldrich:4687-37-0(sigmaaldrich)
  • MOL 文件:4687-37-0.mol

系列性分类

  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Carbonyl Compounds 羰基化合物
  5. Esters - Carbonyl Compounds
  6. C12 to C63 - Esters
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Carbonyl Compounds 羰基化合物
  5. Esters - Carbonyl Compounds
  6. C12 to C63 - Esters

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