CAS 16723-58-3

1H-​2-​Benzothiopyran-​4(3H)​-​one 2,​2-​dioxide

CAS: 16723-58-3

1H-2-Benzothiopyran-4(3H)-one 2,2-dioxide belongs to the group of ketones and isomers. It has an electrophilic character and a nucleophilic character. The tautomerization of this molecule was studied by computational methods. The reactivity of 1H-2-Benzothiopyran-4(3H)-one 2,2-dioxide towards nucleophiles was studied experimentally by using reagents such as hydrogen bond donors, hydrogen bond acceptors, oximes and zwitterions. The conformations of the molecule were analyzed with single crystal x-ray diffraction experiments to find out the most stable conformation for each isomer.

Formula: C₉H₈O₃S

Purity: Min. 95%

Molecular weight: 196.22 g/mol

Ref: 3D-RAA72358