CAS 898777-51-0
:Ethyl 3-nitro-δ-oxobenzenepentanoate
Description:
Ethyl 3-nitro-δ-oxobenzenepentanoate is a chemical compound characterized by its complex structure, which includes an ethyl ester functional group, a nitro group, and a ketone moiety. This compound typically exhibits a yellow to orange color due to the presence of the nitro group, which can also influence its reactivity and stability. It is likely to be soluble in organic solvents such as ethanol and acetone, while its solubility in water may be limited due to the hydrophobic nature of the aromatic ring and the ester group. The presence of the nitro group suggests that the compound may participate in electrophilic aromatic substitution reactions, while the ketone functionality can engage in nucleophilic addition reactions. Additionally, the compound may exhibit biological activity, making it of interest in pharmaceutical research. Safety data should be consulted, as nitro compounds can be hazardous, and appropriate handling and storage conditions are essential to ensure safety in laboratory settings.
Formula:C13H15NO5
InChI:InChI=1S/C13H15NO5/c1-2-19-13(16)8-4-7-12(15)10-5-3-6-11(9-10)14(17)18/h3,5-6,9H,2,4,7-8H2,1H3
InChI key:InChIKey=PBKPVXIYNCRFRG-UHFFFAOYSA-N
SMILES:C(CCCC(OCC)=O)(=O)C1=CC(N(=O)=O)=CC=C1
Synonyms:- Ethyl 3-nitro-δ-oxobenzenepentanoate
- Benzenepentanoic acid, 3-nitro-δ-oxo-, ethyl ester
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