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CAS 17452-27-6

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3-Pyridyl isothiocyanate

Description:
3-Pyridyl isothiocyanate is an organic compound characterized by the presence of a pyridine ring and an isothiocyanate functional group. It is typically a colorless to pale yellow liquid with a pungent odor, indicative of its reactivity and potential as a biological agent. The compound is known for its role in various chemical reactions, particularly in the synthesis of other organic compounds and as a reagent in biological studies. It exhibits moderate solubility in organic solvents and is less soluble in water, which is common for isothiocyanates. 3-Pyridyl isothiocyanate has been studied for its potential applications in medicinal chemistry, particularly in the development of anticancer agents and as a tool in biological research due to its ability to modify proteins through thiocyanate formation. As with many isothiocyanates, it may possess antimicrobial and anticancer properties, making it of interest in pharmacological studies. Proper handling and safety precautions are essential due to its reactivity and potential toxicity.
Formula:C6H4N2S
InChI:InChI=1S/C6H4N2S/c9-5-8-6-2-1-3-7-4-6/h1-4H
InChI key:InChIKey=VMSZFBSYWXMXRF-UHFFFAOYSA-N
SMILES:N(=C=S)C=1C=CC=NC1
Synonyms:
  • 3-Isothiocyanatopyridine
  • Isothiocyanic acid, 3-pyridyl ester
  • Pyridin-3-yl isothiocyanate
  • Pyridine, 3-isothiocyanato-
  • 3-Pyridyl isothiocyanate
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