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CAS 52023-94-6

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3-Isothiocyanato-2-methoxypyridine

Description:
3-Isothiocyanato-2-methoxypyridine is an organic compound characterized by the presence of both isothiocyanate and methoxy functional groups attached to a pyridine ring. Its molecular structure features a pyridine ring substituted at the 2-position with a methoxy group and at the 3-position with an isothiocyanate group. This compound is typically a yellow to brown solid and is known for its reactivity, particularly due to the isothiocyanate moiety, which can participate in nucleophilic reactions and is often used in the synthesis of various organic compounds. It may exhibit biological activity, making it of interest in medicinal chemistry and agricultural applications. The compound is soluble in organic solvents, and its properties can be influenced by the presence of the methoxy group, which can affect its polarity and reactivity. Safety precautions should be taken when handling this compound, as isothiocyanates can be irritants and may pose health risks.
Formula:C7H6N2OS
InChI:InChI=1S/C7H6N2OS/c1-10-7-6(9-5-11)3-2-4-8-7/h2-4H,1H3
InChI key:InChIKey=XTUAFLZKZLLDNU-UHFFFAOYSA-N
SMILES:N(=C=S)C1=C(OC)N=CC=C1
Synonyms:
  • Pyridine, 3-isothiocyanato-2-methoxy-
  • 3-Isothiocyanato-2-methoxypyridine
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