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CAS 2719-32-6

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4-Cyanophenyl isothiocyanate

Description:
4-Cyanophenyl isothiocyanate, with the CAS number 2719-32-6, is an organic compound characterized by the presence of both a cyanophenyl group and an isothiocyanate functional group. It typically appears as a yellow to brownish liquid or solid, depending on the temperature and purity. This compound is known for its reactivity, particularly in nucleophilic substitution reactions, due to the presence of the isothiocyanate group, which can readily react with amines, alcohols, and other nucleophiles. It is often used in organic synthesis and as a reagent in various chemical reactions, including the preparation of thioureas and other derivatives. Additionally, 4-Cyanophenyl isothiocyanate exhibits biological activity, making it of interest in medicinal chemistry and research. Safety precautions should be taken when handling this compound, as it may be toxic and irritant. Proper storage conditions typically involve keeping it in a cool, dry place, away from light and moisture to maintain its stability and reactivity.
Formula:C8H4N2S
InChI:InChI=1S/C8H4N2S/c9-5-7-1-3-8(4-2-7)10-6-11/h1-4H
InChI key:InChIKey=DZFKAXLNKZXNHD-UHFFFAOYSA-N
SMILES:N(=C=S)C1=CC=C(C#N)C=C1
Synonyms:
  • 4-Cyanophenyl isothiocyanate
  • 4-Isothiocyanatobenzenenitrile
  • Benzenenitrile, 4-isothiocyanato- (9CI)
  • Benzonitrile, 4-isothiocyanato-
  • Brn 2802621
  • Isothiocyanic acid, p-cyanophenyl ester
  • p-Cyanophenyl isothiocyanate
  • 3-14-00-01135 (Beilstein Handbook Reference)
  • 4-Isothiocyanatobenzonitrile
  • 4-Isothiocyanatobenzonitrile
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