Tert-butyl 2-[3,5-bis(trifluoromethyl)phenyl]sulfonyl-2-fluoroacetate

• Catalog: OFC1075204180
• CAS: 1075204-18-0
• Category: Trifluoromethylation Agents
• Synonyms: Acetic acid, 2-[[3,5-bis(trifluoromethyl)phenyl]sulfonyl]-2-fluoro-, 1,1-dimethylethyl ester (ACI); 1,1-Dimethylethyl 2-[[3,5-bis(trifluoromethyl)phenyl]sulfonyl]-2-fluoroacetate (ACI)

• InChI: InChI=1S/C14H13F7O4S/c1-12(2,3)25-11(22)10(15)26(23,24)9-5-7(13(16,17)18)4-8(6-9)14(19,20)21/h4-6,10H,1-3H3
• InChI Key: CTUDDPZXWLBZLI-UHFFFAOYSA-N
• Canonical SMILES: CC(C)(C)OC(=O)C(F)S(=O)(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1

• Molecular Formula: C14H13F7O4S
• Molecular Weight: 410.307
• Melting Point: 47-48 °C
• Boiling Point: 390.6 °C
• Density: 1.414 g/cm3

• Exact Mass: 410.0423