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CAS 4426-79-3

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sec-butyl isothiocyanate

Description:
Sec-butyl isothiocyanate is an organic compound characterized by its isothiocyanate functional group, which is derived from the reaction of sec-butylamine with carbon disulfide and subsequent hydrolysis. It is a colorless to pale yellow liquid with a pungent odor, typical of isothiocyanates, which are known for their strong and often unpleasant smells. This compound is soluble in organic solvents but has limited solubility in water. Sec-butyl isothiocyanate is primarily used in chemical synthesis and research, particularly in the study of biological activities and as a potential agrochemical. It exhibits antimicrobial and insecticidal properties, making it of interest in agricultural applications. Additionally, like other isothiocyanates, it may have potential health benefits, including anticancer properties, although further research is needed to fully understand its biological effects. As with many isothiocyanates, it should be handled with care due to its potential irritant effects on the skin and respiratory system.
Formula:C5H9NS
InChI:InChI=1/C5H9NS/c1-3-5(2)6-4-7/h5H,3H2,1-2H3/t5-/m1/s1
InChI key:InChIKey=TUFJIDJGIQOYFY-UHFFFAOYSA-N
SMILES:C(N=C=S)(CC)C
Synonyms:
  • (2R)-2-isothiocyanatobutane
  • (2S)-2-isothiocyanatobutane
  • 1-Methylpropyl isothiocyanate
  • 2-Butyl isothiocyanate
  • 2-Isothiocyanatobutane
  • 224-609-8
  • Butane, 2-isothiocyanato-
  • Isothiocyanic acid, sec-butyl ester
  • sec-Butyl isothiocyanate
  • ART-CHEM-BB B016332
  • See more synonyms
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