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CAS 53053-51-3

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Methyl 4-(methylthio)butanoate

Description:
Methyl 4-(methylthio)butanoate, with the CAS number 53053-51-3, is an organic compound characterized by its ester functional group. It is derived from butanoic acid and contains a methylthio group, which contributes to its unique properties and potential applications. This compound typically appears as a colorless to pale yellow liquid with a fruity odor, making it of interest in flavor and fragrance industries. Its molecular structure includes a butanoate backbone with a methylthio substituent, which can influence its reactivity and solubility. Methyl 4-(methylthio)butanoate is generally soluble in organic solvents and may exhibit low solubility in water due to its hydrophobic characteristics. The compound can be synthesized through esterification reactions, and its derivatives may be explored for various applications, including in the synthesis of more complex organic molecules. Safety data should be consulted for handling and usage, as with any chemical substance, to ensure proper precautions are taken.
Formula:C6H12O2S
InChI:InChI=1S/C6H12O2S/c1-8-6(7)4-3-5-9-2/h3-5H2,1-2H3
InChI key:InChIKey=HQDLZISNHUMXEA-UHFFFAOYSA-N
SMILES:C(CCCSC)(OC)=O
Synonyms:
  • 4-(Methylthio)butyric acid methyl ester
  • Butanoic acid, 4-(methylthio)-, methyl ester
  • Methyl 4-(Methylsulfanyl)Butanoate
  • Methyl 4-(methylthio)butanoate
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