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CAS 99-60-5

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2-Chloro-4-nitrobenzoic acid

Description:
2-Chloro-4-nitrobenzoic acid is an aromatic carboxylic acid characterized by the presence of both a chlorine and a nitro group on the benzene ring. Its molecular formula is C7H4ClN1O3, and it features a carboxylic acid functional group (-COOH) that contributes to its acidic properties. The chlorine atom is located at the second position, while the nitro group is situated at the fourth position relative to the carboxylic acid group. This compound is typically a yellow crystalline solid and is known for its moderate solubility in organic solvents and limited solubility in water. It is used in various applications, including as an intermediate in the synthesis of pharmaceuticals and agrochemicals. The presence of both electron-withdrawing groups (the nitro and chloro substituents) influences its reactivity, making it a useful compound in organic synthesis. Safety precautions should be taken when handling this substance, as it may pose health risks upon exposure.
Formula:C7H4ClNO4
InChI:InChI=1S/C7H4ClNO4/c8-6-3-4(9(12)13)1-2-5(6)7(10)11/h1-3H,(H,10,11)
InChI key:InChIKey=QAYNSPOKTRVZRC-UHFFFAOYSA-N
SMILES:N(=O)(=O)C1=CC(Cl)=C(C(O)=O)C=C1
Synonyms:
  • 2-Chloro-4-Nitobenzoic Acid
  • 2-Chloro-4-Nitrobenzoate
  • 4-Nitro-2-chlorobenzoic acid
  • 4-Nitro-6-Chloro Benzoic Acid
  • Benzoic acid, 2-chloro-4-nitro-
  • NSC 150
  • 2-Chloro-4-nitrobenzoic acid
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