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CAS 19241-37-3

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3-CHLORO-4-METHYLPHENYL ISOTHIOCYANATE

Description:
3-Chloro-4-methylphenyl isothiocyanate is an organic compound characterized by the presence of an isothiocyanate functional group (-N=C=S) attached to a chlorinated aromatic ring. Its molecular structure features a chlorinated phenyl group with a methyl substituent, which contributes to its unique reactivity and properties. This compound is typically a yellow to brownish liquid or solid, depending on the temperature and purity. It is known for its pungent odor, characteristic of isothiocyanates, which can be irritating. 3-Chloro-4-methylphenyl isothiocyanate is primarily used in organic synthesis and may serve as a reagent in various chemical reactions, particularly in the synthesis of other organic compounds. Additionally, it has potential applications in agrochemicals and pharmaceuticals due to its biological activity. As with many isothiocyanates, it may exhibit antimicrobial and anticancer properties, making it of interest in medicinal chemistry. Proper handling and safety precautions are essential, as it can be hazardous upon exposure.
Formula:C8H6ClNS
InChI:InChI=1/C8H6ClNS/c1-6-2-3-7(10-5-11)4-8(6)9/h2-4H,1H3
SMILES:Cc1ccc(cc1Cl)N=C=S
Synonyms:
  • 2-Chloro-4-isothiocyanato-1-methylbenzene
  • 3-Chloro-P-Tolyl Isothiocyanate
  • Nsc135813
  • 3-CHLORO-4-METHYLPHENYL ISOTHIOCYANATE
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