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CAS 6328-00-3

:

4-(3-nitrophenyl)-4-oxobutanoic acid

Description:
4-(3-Nitrophenyl)-4-oxobutanoic acid, with the CAS number 6328-00-3, is an organic compound characterized by its functional groups and structural features. It contains a butanoic acid backbone with a ketone group at the fourth carbon and a nitrophenyl substituent at the third carbon. This compound typically exhibits a yellow to orange color due to the presence of the nitro group, which can also influence its reactivity and solubility. The nitrophenyl group can participate in various chemical reactions, making this compound useful in synthetic organic chemistry. It is likely to be soluble in polar solvents due to the carboxylic acid functionality, while its aromatic nature may provide some degree of hydrophobic character. The presence of both electron-withdrawing (nitro) and electron-donating (carboxylic acid) groups can affect its acidity and reactivity, making it a potential candidate for various applications, including pharmaceuticals and agrochemicals. Safety data should be consulted for handling and storage, as nitro compounds can be hazardous.
Formula:C10H9NO5
InChI:InChI=1/C10H9NO5/c12-9(4-5-10(13)14)7-2-1-3-8(6-7)11(15)16/h1-3,6H,4-5H2,(H,13,14)
SMILES:c1cc(cc(c1)N(=O)=O)C(=O)CCC(=O)O
Synonyms:
  • 3-Nitro-gamma-oxo-benzenebutanoic acid
  • Benzenebutanoic Acid, 3-Nitro-Gamma-Oxo-
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