CAS 898757-93-2
:ethyl 7-(4-hexoxyphenyl)-7-oxo-heptanoate
Description:
Ethyl 7-(4-hexoxyphenyl)-7-oxo-heptanoate, identified by its CAS number 898757-93-2, is an organic compound characterized by its ester functional group, which is typical of ethyl esters. This compound features a heptanoate backbone, indicating it has a seven-carbon chain, and a ketone functional group at the 7-position, contributing to its reactivity and potential applications in organic synthesis. The presence of a 4-hexoxyphenyl substituent suggests that it has aromatic characteristics, which can influence its solubility and interaction with other molecules. The hexoxy group enhances the hydrophobic nature of the compound, potentially affecting its biological activity and partitioning in various environments. Ethyl esters like this one are often used in the synthesis of pharmaceuticals, agrochemicals, and as intermediates in organic reactions. The specific structural features of this compound may also impart unique properties, such as specific melting and boiling points, solubility in organic solvents, and potential applications in drug development or material science.
Formula:C21H32O4
InChI:InChI=1/C21H32O4/c1-3-5-6-10-17-25-19-15-13-18(14-16-19)20(22)11-8-7-9-12-21(23)24-4-2/h13-16H,3-12,17H2,1-2H3
InChI key:InChIKey=YMIKSVOUYDWINA-UHFFFAOYSA-N
SMILES:CCCCCCOc1ccc(cc1)C(=O)CCCCCC(=O)OCC
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