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CAS 39053-42-4

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2,4-Dichloro-3-nitrobenzoic acid

Description:
2,4-Dichloro-3-nitrobenzoic acid is an aromatic compound characterized by the presence of two chlorine atoms and a nitro group attached to a benzoic acid structure. It features a carboxylic acid functional group (-COOH) that contributes to its acidic properties. The chlorine substituents are located at the 2 and 4 positions, while the nitro group is at the 3 position on the benzene ring, which influences its reactivity and solubility. This compound is typically a solid at room temperature and is known for its potential applications in the synthesis of various organic compounds, as well as its use in herbicides and agrochemicals. Its molecular structure imparts specific physical properties, such as melting and boiling points, which are influenced by intermolecular forces like hydrogen bonding and dipole-dipole interactions. Additionally, 2,4-Dichloro-3-nitrobenzoic acid may exhibit toxicity and environmental persistence, necessitating careful handling and disposal in accordance with safety regulations.
Formula:C7H3Cl2NO4
InChI:InChI=1S/C7H3Cl2NO4/c8-4-2-1-3(7(11)12)5(9)6(4)10(13)14/h1-2H,(H,11,12)
InChI key:InChIKey=KBQPYERMRVPJDC-UHFFFAOYSA-N
SMILES:N(=O)(=O)C1=C(Cl)C(C(O)=O)=CC=C1Cl
Synonyms:
  • Benzoic acid, 2,4-dichloro-3-nitro-
  • 2,4-Dichloro-3-nitrobenzoic acid
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