Basic information
- Standard SMILES
O=[N+]([O-])c1ccc(OS(=O)(=O)C(F)(F)F)cc1F- InChIKey
ANXRHNZOWKWYFI-UHFFFAOYSA-N- Molecular formula
- C7H3F4NO5S
- Average molar mass
- 289.16 g/mol
- Monoisotopic mass
- 288.96680602
Names & identifiers
- Preferred name
- 3-Fluoro-4-nitrophenyl trifluoromethanesulfonate
- IUPAC
- (3-fluoro-4-nitrophenyl) trifluoromethanesulfonate
Names & synonyms
3-fluoro-4-nitrophenyl trifluoromethanesulfonate256935-94-1(3-Fluoro-4-nitro-phenyl) trifluoromethanesulfonate3-Fluoro-4-nitrophenyl triflate3-Fluoro-4-nitrophenyl trifluoromethanesulphonateSCHEMBL1578830MFCD18379767AKOS040768614DB-128367C91334(3-fluoro-4-nitrophenyl) trifluoromethanesulfonatetrifluoro-methanesulfonic acid 3-fluoro-4-nitro-phenyl ester
Database identifiers
- PubChem CID
- 21998735
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 97.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 411
Related reactions
14 records
Compound notes
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