Organofluorine / Alfa Chemistry
5-Chloro-2-[(trifluoromethyl)thio]-1H-isoindole-1,3(2H)-dione

5-Chloro-2-[(trifluoromethyl)thio]-1H-isoindole-1,3(2H)-dione

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5-Chloro-2-[(trifluoromethyl)thio]-1H-isoindole-1,3(2H)-dione
Catalog OFC1857384587
CAS 1857384-58-7
Category Trifluoromethylation Agents
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Other Identifiers Chemical Data Computational Chemistry
InChI InChI=1S/C9H3ClF3NO2S/c10-4-1-2-5-6(3-4)8(16)14(7(5)15)17-9(11,12)13/h1-3H
InChI Key DENPTHFHSCKOHA-UHFFFAOYSA-N
Canonical SMILES O=C1c2ccc(Cl)cc2C(=O)N1SC(F)(F)F
Molecular Formula C9H3ClF3NO2S
Molecular Weight 281.642
Boiling Point 299.7 °C
Density 1.73 g/cm3
Exact Mass 280.9525

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