Organofluorine / Alfa Chemistry
2-(2-Chlorophenyl)-1-trifluoromethyl-benzo[b]thiophenium triflate

2-(2-Chlorophenyl)-1-trifluoromethyl-benzo[b]thiophenium triflate

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2-(2-Chlorophenyl)-1-trifluoromethyl-benzo[b]thiophenium triflate
Catalog OFC1214756441
CAS 1214756-44-1
Category Trifluoromethylation Agents
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Other Identifiers Chemical Data Computational Chemistry
InChI InChI=1S/C15H9ClF3S.CHF3O3S/c16-12-7-3-2-6-11(12)14-9-10-5-1-4-8-13(10)20(14)15(17,18)19;2-1(3,4)8(5,6)7/h1-9H;(H,5,6,7)/q+1;/p-1
InChI Key BHRFEXDTBOTQEB-UHFFFAOYSA-M
Canonical SMILES FC(F)(F)[s+]1c(-c2ccccc2Cl)cc2ccccc21.O=S(=O)([O-])C(F)(F)F
Molecular Formula C16H9ClF6O3S2
Molecular Weight 462.82
Melting Point 137-139 °C
Exact Mass 461.9586

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