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CAS 2604-45-7

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2,3,5,6-Tetramethylbenzoic acid

Description:
2,3,5,6-Tetramethylbenzoic acid is an aromatic carboxylic acid characterized by a benzoic acid structure with four methyl groups attached to the benzene ring at the 2, 3, 5, and 6 positions. This compound is typically a white to off-white solid at room temperature and is known for its relatively low solubility in water, but it is soluble in organic solvents such as ethanol and acetone. The presence of multiple methyl groups contributes to its steric hindrance, which can influence its reactivity and interactions with other molecules. It has applications in organic synthesis and as a building block in the production of various chemical compounds. Additionally, due to its structural features, it may exhibit unique properties such as altered melting and boiling points compared to simpler benzoic acids. Safety data indicates that, like many organic acids, it should be handled with care to avoid skin and eye irritation.
Formula:C11H14O2
InChI:InChI=1S/C11H14O2/c1-6-5-7(2)9(4)10(8(6)3)11(12)13/h5H,1-4H3,(H,12,13)
InChI key:InChIKey=STIDRZRESMTQBD-UHFFFAOYSA-N
SMILES:C(O)(=O)C1=C(C)C(C)=CC(C)=C1C
Synonyms:
  • Benzoic acid, 2,3,5,6-tetramethyl-
  • Brn 2328778
  • Nsc 409541
  • 2,3,5,6-Tetramethylbenzoic acid
  • 2,3,5,6-Tetramethylbenzoic acid
  • 4-09-00-01894 (Beilstein Handbook Reference)
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