CAS 898791-43-0
:4-(1,1-Dimethylethyl)-ε-oxobenzenehexanoic acid
Description:
4-(1,1-Dimethylethyl)-ε-oxobenzenehexanoic acid, identified by its CAS number 898791-43-0, is an organic compound characterized by its unique structure that includes a benzene ring substituted with a tert-butyl group and a hexanoic acid chain. This compound features a keto group (the ε-oxobenzene moiety) which contributes to its reactivity and potential applications in various chemical processes. The presence of the tert-butyl group enhances its hydrophobic properties, making it less soluble in water but more soluble in organic solvents. This compound may exhibit interesting biological activities due to its structural features, which could be relevant in fields such as pharmaceuticals or agrochemicals. Additionally, its molecular structure suggests potential for use as an intermediate in organic synthesis or as a building block for more complex molecules. Overall, the characteristics of this compound, including its functional groups and hydrophobic nature, make it a subject of interest in both industrial and research applications.
Formula:C16H22O3
InChI:InChI=1S/C16H22O3/c1-16(2,3)13-10-8-12(9-11-13)14(17)6-4-5-7-15(18)19/h8-11H,4-7H2,1-3H3,(H,18,19)
InChI key:InChIKey=WBPZIZTWKYCJSM-UHFFFAOYSA-N
SMILES:C(CCCCC(O)=O)(=O)C1=CC=C(C(C)(C)C)C=C1
Synonyms:- 4-(1,1-Dimethylethyl)-ε-oxobenzenehexanoic acid
- Benzenehexanoic acid, 4-(1,1-dimethylethyl)-ε-oxo-
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