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CAS 100959-22-6

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Methyl 2-bromo-4-nitrobenzoate

Description:
Methyl 2-bromo-4-nitrobenzoate is an organic compound characterized by its aromatic structure, which includes a bromine atom and a nitro group attached to a benzoate moiety. This compound features a methyl ester functional group, contributing to its solubility in organic solvents. The presence of the bromine atom introduces electrophilic properties, making it a useful intermediate in various chemical reactions, including nucleophilic substitutions. The nitro group, known for its electron-withdrawing effects, enhances the reactivity of the aromatic ring, facilitating further functionalization. Methyl 2-bromo-4-nitrobenzoate is typically a yellow to brown solid, and it is used in synthetic organic chemistry for the preparation of more complex molecules. Its applications may extend to pharmaceuticals and agrochemicals, where it serves as a building block for various derivatives. As with many halogenated compounds, it is important to handle this substance with care due to potential toxicity and environmental concerns.
Formula:C8H6BrNO4
InChI:InChI=1S/C8H6BrNO4/c1-14-8(11)6-3-2-5(10(12)13)4-7(6)9/h2-4H,1H3
InChI key:InChIKey=XYMZAFDNPJLOTP-UHFFFAOYSA-N
SMILES:C(OC)(=O)C1=C(Br)C=C(N(=O)=O)C=C1
Synonyms:
  • 2-Bromo-4-nitro-benzoic acid methyl ester
  • Methyl 2-bromo-4-nitrobenzoate
  • Benzoic acid, 2-bromo-4-nitro-, methyl ester
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