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CAS 66405-41-2

:

methyl (4-oxocyclohexyl)acetate

Description:
Methyl (4-oxocyclohexyl)acetate, with the CAS number 66405-41-2, is an organic compound characterized by its ester functional group. It features a cyclohexane ring with a ketone group at the 4-position, contributing to its unique reactivity and properties. This compound is typically a colorless to pale yellow liquid with a pleasant, fruity odor, making it potentially useful in flavor and fragrance applications. Its molecular structure suggests moderate polarity due to the presence of both ester and ketone functionalities, which can influence its solubility in various solvents. Methyl (4-oxocyclohexyl)acetate may exhibit moderate volatility and is expected to have a relatively low boiling point compared to larger, more complex molecules. In terms of safety, like many organic esters, it may pose risks such as skin irritation or respiratory issues upon exposure, necessitating appropriate handling and storage measures. Overall, its unique structural features and properties make it of interest in both industrial and research contexts.
Formula:C9H14O3
InChI:InChI=1/C9H14O3/c1-12-9(11)6-7-2-4-8(10)5-3-7/h7H,2-6H2,1H3
SMILES:COC(=O)CC1CCC(=O)CC1
Synonyms:
  • (4-Oxo-cyclohexyl)-acetic acid meth
  • Yl Ester
  • Cyclohexaneacetic Acid, 4-Oxo-, Methyl Ester
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