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CAS 110284-79-2

:

2-[(4,6-Dimethoxy-2-pyrimidinyl)thio]benzoic acid

Description:
2-[(4,6-Dimethoxy-2-pyrimidinyl)thio]benzoic acid, with the CAS number 110284-79-2, is a chemical compound characterized by its unique structure that combines a benzoic acid moiety with a pyrimidine ring substituted with two methoxy groups. This compound typically exhibits properties associated with both aromatic and heterocyclic compounds, including potential solubility in organic solvents and moderate polarity due to the presence of the carboxylic acid functional group. The dimethoxy substitutions on the pyrimidine ring can influence its electronic properties and reactivity, potentially enhancing its biological activity. The thioether linkage introduces additional characteristics, such as potential nucleophilicity and the ability to participate in various chemical reactions. This compound may be of interest in medicinal chemistry and drug development, particularly for its potential pharmacological properties. Its synthesis and characterization would involve standard organic chemistry techniques, and it may be studied for applications in areas such as agrochemicals or pharmaceuticals.
Formula:C13H12N2O4S
InChI:InChI=1S/C13H12N2O4S/c1-18-10-7-11(19-2)15-13(14-10)20-9-6-4-3-5-8(9)12(16)17/h3-7H,1-2H3,(H,16,17)
InChI key:InChIKey=DFQPVZIMUBRHGM-UHFFFAOYSA-N
SMILES:S(C1=C(C(O)=O)C=CC=C1)C=2N=C(OC)C=C(OC)N2
Synonyms:
  • 2-(4,6-Dimethoxypyrimidin-2-ylsulfanyl)benzoic acid
  • 2-[(4,6-Dimethoxy-2-pyrimidinyl)thio]benzoic acid
  • 2-[(4,6-Dimethoxypyrimidin-2-yl)sulfanyl]benzoic acid
  • Benzoic acid, 2-[(4,6-dimethoxy-2-pyrimidinyl)thio]-
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