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CAS 51333-75-6

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2-(methylthio)phenyl isothiocyanate

Description:
2-(Methylthio)phenyl isothiocyanate is an organic compound characterized by the presence of both a phenyl group and an isothiocyanate functional group. It features a methylthio substituent, which contributes to its unique chemical properties. This compound typically appears as a yellow to brown liquid and has a pungent odor, characteristic of isothiocyanates. It is known for its reactivity, particularly in nucleophilic substitution reactions, due to the electrophilic nature of the isothiocyanate group. 2-(Methylthio)phenyl isothiocyanate is often utilized in organic synthesis and may have applications in the development of agrochemicals or pharmaceuticals. Additionally, it can exhibit biological activity, including potential antimicrobial or anticancer properties, making it of interest in medicinal chemistry. Safety precautions are necessary when handling this compound, as isothiocyanates can be irritants and may pose health risks upon exposure. Overall, its unique structure and reactivity make it a valuable compound in various chemical research fields.
Formula:C8H7NS2
InChI:InChI=1/C8H7NS2/c1-11-8-5-3-2-4-7(8)9-6-10/h2-5H,1H3
SMILES:CSc1ccccc1N=C=S
Synonyms:
  • 1-Isothiocyanato-2-(Methylsulfanyl)Benzene
  • 2-(Methylthio)phenyl isothiocyanate
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