CAS 898791-67-8
:4-(Ethoxycarbonyl)-ε-oxobenzenehexanoic acid
Description:
4-(Ethoxycarbonyl)-ε-oxobenzenehexanoic acid, with the CAS number 898791-67-8, is an organic compound characterized by its unique structure that includes an ethoxycarbonyl group and a hexanoic acid moiety. This compound features a benzene ring substituted with an oxo group and a hexanoic acid chain, which contributes to its potential applications in organic synthesis and medicinal chemistry. The presence of the ethoxycarbonyl group enhances its reactivity, making it a useful intermediate in various chemical reactions. Additionally, the compound's functional groups suggest it may exhibit properties such as solubility in organic solvents and potential interactions with biological systems. Its molecular structure allows for the possibility of forming hydrogen bonds, influencing its physical properties like melting and boiling points. Overall, 4-(Ethoxycarbonyl)-ε-oxobenzenehexanoic acid represents a versatile building block in the synthesis of more complex organic molecules.
Formula:C15H18O5
InChI:InChI=1S/C15H18O5/c1-2-20-15(19)12-9-7-11(8-10-12)13(16)5-3-4-6-14(17)18/h7-10H,2-6H2,1H3,(H,17,18)
InChI key:InChIKey=TZDMKRVFQLPODM-UHFFFAOYSA-N
SMILES:C(CCCCC(O)=O)(=O)C1=CC=C(C(OCC)=O)C=C1
Synonyms:- Benzenehexanoic acid, 4-(ethoxycarbonyl)-ε-oxo-
- 4-(Ethoxycarbonyl)-ε-oxobenzenehexanoic acid
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