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CAS 6954-70-7

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2,5-Dimethyl-4-nitrobenzoic acid

Description:
2,5-Dimethyl-4-nitrobenzoic acid is an aromatic carboxylic acid characterized by its nitro and methyl substituents on the benzene ring. This compound features a benzoic acid structure with a nitro group at the para position and two methyl groups at the 2 and 5 positions. It typically appears as a solid at room temperature and is known for its moderate solubility in organic solvents, while being less soluble in water due to the hydrophobic nature of the aromatic ring and the bulky methyl groups. The presence of the nitro group contributes to its electron-withdrawing properties, which can influence its reactivity and acidity. This compound is often used in organic synthesis and may serve as an intermediate in the production of dyes, pharmaceuticals, or other chemical compounds. Safety precautions should be taken when handling this substance, as nitro compounds can be hazardous and may pose environmental risks. Proper storage and disposal methods are essential to mitigate any potential hazards associated with its use.
Formula:C9H9NO4
InChI:InChI=1S/C9H9NO4/c1-5-4-8(10(13)14)6(2)3-7(5)9(11)12/h3-4H,1-2H3,(H,11,12)
InChI key:InChIKey=WQJLIVQRJOLTMH-UHFFFAOYSA-N
SMILES:C(O)(=O)C1=C(C)C=C(N(=O)=O)C(C)=C1
Synonyms:
  • Benzoic acid, 2,5-dimethyl-4-nitro-
  • 2,5-Dimethyl-4-nitrobenzoic acid
  • NSC 67713
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