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CAS 100117-62-2

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ethyl (3,5-dimethylphenyl)(oxo)acetate

Description:
Ethyl (3,5-dimethylphenyl)(oxo)acetate, with the CAS number 100117-62-2, is an organic compound characterized by its ester functional group, which is derived from acetic acid and an aromatic ring. This compound features a 3,5-dimethylphenyl group, indicating the presence of two methyl substituents on a phenyl ring at the 3 and 5 positions, contributing to its hydrophobic character and potential for various chemical interactions. The oxo group (carbonyl) attached to the acetyl moiety enhances its reactivity, making it a suitable candidate for various synthetic applications, including in the production of pharmaceuticals and agrochemicals. Ethyl (3,5-dimethylphenyl)(oxo)acetate is likely to exhibit moderate solubility in organic solvents and limited solubility in water due to its hydrophobic aromatic structure. Its chemical properties may include reactivity towards nucleophiles and participation in condensation reactions, making it a versatile intermediate in organic synthesis. Safety data should be consulted for handling and storage, as with all chemical substances.
Formula:C12H14O3
InChI:InChI=1/C12H14O3/c1-4-15-12(14)11(13)10-6-8(2)5-9(3)7-10/h5-7H,4H2,1-3H3
SMILES:CCOC(=O)C(=O)c1cc(C)cc(C)c1
Synonyms:
  • 2Ovvr C1 E1 [Wln]
  • 3,5-Dimethylbenzoylformic acid ethyl ester
  • Benzeneacetic acid, 3,5-dimethyl-alpha-oxo-, ethyl ester
  • Ethyl (3,5-dimethylphenyl)(oxo)acetate
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