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CAS 247225-29-2

:

3-[(4,6-Dimethyl-2-pyrimidinyl)thio]propanoic acid

Description:
3-[(4,6-Dimethyl-2-pyrimidinyl)thio]propanoic acid, identified by its CAS number 247225-29-2, is a chemical compound characterized by its unique structure that includes a propanoic acid moiety linked to a thioether group containing a pyrimidine ring. The presence of the 4,6-dimethyl substitution on the pyrimidine ring contributes to its chemical properties, potentially influencing its reactivity and solubility. This compound may exhibit acidic behavior due to the carboxylic acid functional group, allowing it to participate in various chemical reactions, including esterification and amidation. Additionally, the thioether linkage can impart specific biological activities, making it of interest in pharmaceutical research. The molecular structure suggests potential applications in medicinal chemistry, particularly in the development of compounds with targeted biological effects. As with many organic compounds, its physical properties, such as melting point, boiling point, and solubility, would depend on the specific conditions and the presence of other functional groups.
Formula:C9H12N2O2S
InChI:InChI=1S/C9H12N2O2S/c1-6-5-7(2)11-9(10-6)14-4-3-8(12)13/h5H,3-4H2,1-2H3,(H,12,13)
InChI key:InChIKey=MULFLAMWNBZYLU-UHFFFAOYSA-N
SMILES:S(CCC(O)=O)C=1N=C(C)C=C(C)N1
Synonyms:
  • 2-(2-Carboxyethyl)thio-4,6-dimethylpyrimidine
  • 3-[(4,6-Dimethylpyrimidin-2-yl)sulfanyl]propanoic acid
  • 3-[(4,6-Dimethyl-2-pyrimidinyl)thio]propanoic acid
  • Propanoic acid, 3-[(4,6-dimethyl-2-pyrimidinyl)thio]-
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