CAS 898757-73-8
:Ethyl 4-(1-methylethoxy)-ε-oxobenzenehexanoate
Description:
Ethyl 4-(1-methylethoxy)-ε-oxobenzenehexanoate, identified by its CAS number 898757-73-8, is an organic compound characterized by its ester functional group, which is typical of many organic compounds used in various applications, including pharmaceuticals and agrochemicals. This compound features a benzene ring substituted with an ethoxy group and a hexanoate chain, contributing to its hydrophobic properties. The presence of the ε-oxobenzene moiety indicates that it may exhibit unique reactivity patterns, particularly in condensation reactions or as a potential intermediate in synthetic pathways. Ethyl esters generally have pleasant odors and are often used as flavoring agents or solvents. The molecular structure suggests that it may have moderate solubility in organic solvents while being less soluble in water, which is common for larger organic molecules. Its specific applications and behavior in chemical reactions would depend on its reactivity profile, which can be influenced by the steric and electronic effects of the substituents on the benzene ring and the alkyl chains.
Formula:C17H24O4
InChI:InChI=1S/C17H24O4/c1-4-20-17(19)8-6-5-7-16(18)14-9-11-15(12-10-14)21-13(2)3/h9-13H,4-8H2,1-3H3
InChI key:InChIKey=JJLHRUXVNHYAGY-UHFFFAOYSA-N
SMILES:C(CCCCC(OCC)=O)(=O)C1=CC=C(OC(C)C)C=C1
Synonyms:- Benzenehexanoic acid, 4-(1-methylethoxy)-ε-oxo-, ethyl ester
- Ethyl 4-(1-methylethoxy)-ε-oxobenzenehexanoate
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