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CAS 1088994-22-2

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5-Methyl-2-(2-pyrimidinyl)benzoic acid

Description:
5-Methyl-2-(2-pyrimidinyl)benzoic acid is an organic compound characterized by its aromatic structure, which includes a benzoic acid moiety substituted with a methyl group and a pyrimidine ring. This compound features a carboxylic acid functional group, contributing to its acidic properties and potential for hydrogen bonding. The presence of the pyrimidine ring, a six-membered heterocyclic structure containing nitrogen atoms, imparts unique electronic properties and can influence the compound's reactivity and solubility. Typically, compounds like this may exhibit biological activity, making them of interest in pharmaceutical research. The molecular structure allows for various interactions, including pi-stacking and hydrogen bonding, which can be significant in biological systems or when forming complexes with other molecules. Additionally, the compound's solubility and stability can be affected by pH and solvent conditions, which are important considerations for its practical applications in synthesis or drug formulation. Overall, 5-Methyl-2-(2-pyrimidinyl)benzoic acid represents a versatile structure with potential utility in various chemical and biological contexts.
Formula:C12H10N2O2
InChI:InChI=1S/C12H10N2O2/c1-8-3-4-9(10(7-8)12(15)16)11-13-5-2-6-14-11/h2-7H,1H3,(H,15,16)
InChI key:InChIKey=WKBKHXGASBZRMI-UHFFFAOYSA-N
SMILES:C(O)(=O)C1=C(C=CC(C)=C1)C=2N=CC=CN2
Synonyms:
  • Benzoic acid, 5-methyl-2-(2-pyrimidinyl)-
  • 5-Methyl-2-(2-pyrimidinyl)benzoic acid
  • 5-Methyl-2-(pyrimidin-2-yl)benzoic acid
  • 5-Methyl-2-(2-pyrimidyl)benzoic Acid
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