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CAS 18780-68-2

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Carbonic acid, 4-(chlorocarbonyl)-2,6-dimethoxyphenyl ethyl ester

Description:
Carbonic acid, 4-(chlorocarbonyl)-2,6-dimethoxyphenyl ethyl ester, identified by CAS number 18780-68-2, is an organic compound characterized by its ester functional group and the presence of a chlorocarbonyl moiety. This compound features a phenyl ring substituted with two methoxy groups at the 2 and 6 positions, enhancing its reactivity and solubility in organic solvents. The chlorocarbonyl group introduces electrophilic characteristics, making it a potential intermediate in various chemical reactions, particularly in the synthesis of pharmaceuticals and agrochemicals. The ethyl ester component contributes to its overall stability and may influence its biological activity. Carbonic acid derivatives are often involved in carbon dioxide capture and storage applications, as well as in the development of materials with specific chemical properties. Safety data should be consulted for handling, as compounds with chlorinated functionalities can pose health risks. Overall, this compound exemplifies the complexity and utility of substituted aromatic esters in organic chemistry.
Formula:C12H13ClO6
InChI:InChI=1S/C12H13ClO6/c1-4-18-12(15)19-10-8(16-2)5-7(11(13)14)6-9(10)17-3/h5-6H,4H2,1-3H3
InChI key:InChIKey=SUGYMTMPHHMOIU-UHFFFAOYSA-N
SMILES:O(C(OCC)=O)C1=C(OC)C=C(C(Cl)=O)C=C1OC
Synonyms:
  • Benzoyl chloride, 4-hydroxy-3,5-dimethoxy-, ethyl carbonate
  • 3,5-Dimethoxy-4-(ethoxycarbonyloxy)benzoyl chloride
  • Carbonic acid, ethyl ester, ester with 4-hydroxy-3,5-dimethoxybenzoyl chloride
  • Carbonic acid, 4-(chlorocarbonyl)-2,6-dimethoxyphenyl ethyl ester
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