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CAS 55225-88-2

:

1-isocyanato-3-[(trifluoromethyl)sulfanyl]benzene

Description:
1-Isocyanato-3-[(trifluoromethyl)sulfanyl]benzene, with the CAS number 55225-88-2, is an organic compound characterized by the presence of an isocyanate functional group and a trifluoromethylthio group attached to a benzene ring. This compound typically exhibits a high reactivity due to the isocyanate group, which can readily participate in nucleophilic addition reactions, making it useful in the synthesis of various polymers and pharmaceuticals. The trifluoromethylthio group enhances the compound's lipophilicity and may influence its biological activity and stability. Additionally, the presence of fluorine atoms often imparts unique electronic properties, potentially affecting the compound's reactivity and interaction with other molecules. The compound is likely to be a solid at room temperature and may require careful handling due to the toxicity associated with isocyanates. Overall, 1-isocyanato-3-[(trifluoromethyl)sulfanyl]benzene is of interest in materials science and medicinal chemistry due to its distinctive structural features and reactivity.
Formula:C8H4F3NOS
InChI:InChI=1/C8H4F3NOS/c9-8(10,11)14-7-3-1-2-6(4-7)12-5-13/h1-4H
SMILES:c1cc(cc(c1)SC(F)(F)F)N=C=O
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