CAS 75227-18-8
:ethyl 4-(3-nitrophenyl)-4-oxobutanoate
Description:
Ethyl 4-(3-nitrophenyl)-4-oxobutanoate, identified by its CAS number 75227-18-8, is an organic compound characterized by its ester functional group and a nitrophenyl substituent. This compound features a butanoate backbone, which includes a ketone group adjacent to the ester, contributing to its reactivity and potential applications in organic synthesis. The presence of the nitro group on the phenyl ring enhances its electrophilic character, making it useful in various chemical reactions, including nucleophilic substitutions and coupling reactions. Ethyl 4-(3-nitrophenyl)-4-oxobutanoate is typically a solid or liquid at room temperature, depending on its purity and specific formulation. It is soluble in organic solvents, which facilitates its use in laboratory settings. This compound may exhibit biological activity, making it of interest in medicinal chemistry and drug development. However, as with many nitro compounds, it should be handled with care due to potential toxicity and environmental concerns. Proper safety protocols should be followed when working with this substance.
Formula:C12H13NO5
InChI:InChI=1/C12H13NO5/c1-2-18-12(15)7-6-11(14)9-4-3-5-10(8-9)13(16)17/h3-5,8H,2,6-7H2,1H3
SMILES:CCOC(=O)CCC(=O)c1cccc(c1)N(=O)=O
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