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CAS 3698-95-1

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Methyl octyl sulfide

Description:
Methyl octyl sulfide, with the CAS number 3698-95-1, is an organic compound classified as a thioether. It features a methyl group attached to an octyl chain, with a sulfur atom linking the two. This compound is typically characterized by its hydrophobic nature due to the long hydrocarbon chain, which contributes to its low solubility in water but higher solubility in organic solvents. Methyl octyl sulfide is often recognized for its distinct odor, which can be reminiscent of garlic or onion, a characteristic common to many sulfur-containing compounds. It is used in various applications, including as a flavoring agent and in the synthesis of other chemical compounds. Additionally, its properties may include moderate volatility and a relatively low boiling point compared to larger organic molecules. Safety data indicates that, like many thioethers, it should be handled with care due to potential irritant effects and the need for proper ventilation during use.
Formula:C9H20S
InChI:InChI=1S/C9H20S/c1-3-4-5-6-7-8-9-10-2/h3-9H2,1-2H3
InChI key:InChIKey=AHCJTMBRROLNHV-UHFFFAOYSA-N
SMILES:C(CCCSC)CCCC
Synonyms:
  • 1-(Methylsulfanyl)Octane
  • 1-(Methylthio)octane
  • 1-Methylsulfanyloctane
  • 1-Methylthiooctane
  • 2-Thiadecane
  • Methyl 1-octyl sulfide
  • Methyl n-octyl sulfide
  • Methyl octyl sulfide
  • Octane, 1-(methylthio)-
  • Octyl methyl sulfide
  • See more synonyms
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