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CAS 938063-63-9

:

Methyl 3-[(2,2-dimethyl-1-oxobutyl)thio]propanoate

Description:
Methyl 3-[(2,2-dimethyl-1-oxobutyl)thio]propanoate, identified by its CAS number 938063-63-9, is an organic compound characterized by its ester functional group, which is typical of methyl esters. This compound features a propanoate backbone, with a thioether substituent that includes a 2,2-dimethyl-1-oxobutyl group. The presence of sulfur in the thioether linkage imparts unique properties, such as potential reactivity in nucleophilic substitution reactions. The compound is likely to be a colorless to pale yellow liquid, exhibiting moderate volatility and solubility in organic solvents, while being less soluble in water due to its hydrophobic characteristics. Its molecular structure suggests potential applications in organic synthesis, possibly as an intermediate in the production of pharmaceuticals or agrochemicals. Additionally, the presence of the thioether group may enhance its biological activity or influence its interaction with biological systems. As with many organic compounds, safety data should be consulted to understand its handling and potential hazards.
Formula:C10H18O3S
InChI:InChI=1S/C10H18O3S/c1-5-10(2,3)9(12)14-7-6-8(11)13-4/h5-7H2,1-4H3
InChI key:InChIKey=OSAXTZWRAGDRFI-UHFFFAOYSA-N
SMILES:C(C(SCCC(OC)=O)=O)(CC)(C)C
Synonyms:
  • 2X1&1&Vs2Vo1
  • 3-[(2,2-Dimethyl-1-oxobutyl)thio]propionic acid methyl ester
  • 3-[(2,2-Diméthylbutanoyl)sulfanyl]propanoate de méthyle
  • Dimethylbutyryl-S-Methyl Mercaptopropionate
  • Methyl 3-[(2,2-dimethyl-1-oxobutyl)thio]propanoate
  • Methyl 3-[(2,2-dimethylbutanoyl)sulfanyl]propanoate
  • Methyl 3-[(2,2-dimethylbutanoyl)thio]propanoate
  • Methyl 3-[(2,2-dimethylbutanoyl)thio]propionate
  • Methyl-3-[(2,2-dimethylbutanoyl)sulfanyl]propanoat
  • Propanoic acid, 3-[(2,2-dimethyl-1-oxobutyl)thio]-, methyl ester
  • See more synonyms
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