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CAS 5435-91-6

:

ethyl 5,5-dimethyl-3-oxohexanoate

Description:
Ethyl 5,5-dimethyl-3-oxohexanoate, with the CAS number 5435-91-6, is an organic compound belonging to the class of esters. It is characterized by its ester functional group, which is derived from the reaction of an alcohol (in this case, ethanol) and a carboxylic acid. This compound features a hexanoate backbone with two methyl groups attached to the fifth carbon, contributing to its branched structure. The presence of a keto group (oxo) at the third carbon enhances its reactivity and potential applications in organic synthesis. Ethyl 5,5-dimethyl-3-oxohexanoate is typically a colorless to pale yellow liquid with a fruity odor, making it useful in flavor and fragrance industries. It is soluble in organic solvents and has limited solubility in water. The compound may be utilized in the synthesis of various pharmaceuticals, agrochemicals, and other organic compounds due to its versatile reactivity. Safety data should be consulted for handling and storage, as with all chemical substances.
Formula:C10H18O3
InChI:InChI=1/C10H18O3/c1-5-13-9(12)6-8(11)7-10(2,3)4/h5-7H2,1-4H3
SMILES:CCOC(=O)CC(=O)CC(C)(C)C
Synonyms:
  • Hexanoic acid, 5,5-dimethyl-3-oxo-, ethyl ester
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