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CAS 951889-40-0

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Ethyl 4-(1,1-dimethylethyl)-2,6-dimethyl-δ-oxobenzenepentanoate

Description:
Ethyl 4-(1,1-dimethylethyl)-2,6-dimethyl-δ-oxobenzenepentanoate, with the CAS number 951889-40-0, is an organic compound characterized by its complex structure, which includes an ethyl ester functional group and a substituted aromatic ring. This compound features a tert-butyl group, contributing to its steric bulk, and multiple methyl groups that enhance its hydrophobic character. The presence of the δ-oxobenzene moiety indicates that it contains a ketone functional group, which can influence its reactivity and interactions with other molecules. Typically, compounds of this nature may exhibit properties such as moderate solubility in organic solvents and low solubility in water, making them suitable for various applications in organic synthesis and potentially in pharmaceuticals or agrochemicals. The specific physical and chemical properties, such as boiling point, melting point, and reactivity, would depend on the precise molecular interactions and the environment in which the compound is studied. Overall, this compound represents a unique structure that may have interesting applications in chemical research and industry.
Formula:C19H28O3
InChI:InChI=1S/C19H28O3/c1-7-22-17(21)10-8-9-16(20)18-13(2)11-15(12-14(18)3)19(4,5)6/h11-12H,7-10H2,1-6H3
InChI key:InChIKey=RGVNYQPPMMIDTK-UHFFFAOYSA-N
SMILES:C(CCCC(OCC)=O)(=O)C1=C(C)C=C(C(C)(C)C)C=C1C
Synonyms:
  • Ethyl 4-(1,1-dimethylethyl)-2,6-dimethyl-δ-oxobenzenepentanoate
  • Benzenepentanoic acid, 4-(1,1-dimethylethyl)-2,6-dimethyl-δ-oxo-, ethyl ester
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