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CAS 890098-28-9

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Ethyl 2-(3-nitrobenzoyl)benzoate

Description:
Ethyl 2-(3-nitrobenzoyl)benzoate is an organic compound characterized by its ester functional group and the presence of a nitro group on the aromatic ring. It features a benzoate moiety, which is derived from benzoic acid, and an ethyl group that contributes to its solubility and volatility. The compound typically appears as a yellowish solid or liquid, depending on its purity and specific conditions. It is known for its potential applications in organic synthesis, particularly in the development of pharmaceuticals and agrochemicals, due to the reactivity of the nitro group. The presence of the nitro substituent can also influence the compound's electronic properties, making it useful in various chemical reactions, such as nucleophilic substitutions. Ethyl 2-(3-nitrobenzoyl)benzoate may exhibit moderate to low solubility in water but is generally soluble in organic solvents like ethanol and dichloromethane. Safety precautions should be taken when handling this compound, as nitro compounds can be hazardous.
Formula:C16H13NO5
InChI:InChI=1S/C16H13NO5/c1-2-22-16(19)14-9-4-3-8-13(14)15(18)11-6-5-7-12(10-11)17(20)21/h3-10H,2H2,1H3
InChI key:InChIKey=WMSZMJXCZHWMQV-UHFFFAOYSA-N
SMILES:C(=O)(C1=C(C(OCC)=O)C=CC=C1)C2=CC(N(=O)=O)=CC=C2
Synonyms:
  • Ethyl 2-(3-nitrobenzoyl)benzoate
  • Benzoic acid, 2-(3-nitrobenzoyl)-, ethyl ester
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