Organofluorine / Alfa Chemistry
2,3,4,5,6-pentachloro-N-fluoropyridinium trifluoromethanesulfonate

2,3,4,5,6-pentachloro-N-fluoropyridinium trifluoromethanesulfonate

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2,3,4,5,6-pentachloro-N-fluoropyridinium trifluoromethanesulfonate
Catalog OFC130433704
CAS 130433-70-4
Category Trifluoromethylthiolation Agents
Synonyms n-Fluoropentachloropyridinium triflate
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Other Identifiers Chemical Data Computational Chemistry
InChI InChI=1S/C5Cl5FN.CHF3O3S/c6-1-2(7)4(9)12(11)5(10)3(1)8;2-1(3,4)8(5,6)7/h;(H,5,6,7)/q+1;/p-1
InChI Key SOFUZJVNPWXHOH-UHFFFAOYSA-M
Canonical SMILES F[n+]1c(Cl)c(Cl)c(Cl)c(Cl)c1Cl.O=S(=O)([O-])C(F)(F)F
Molecular Formula C6Cl5F4NO3S
Molecular Weight 419.394
Melting Point 123-124 °C
Appearance white crystalline solid
Exact Mass 416.7978

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