Basic information
- Standard SMILES
O=[N+]([O-])c1ncccc1OS(=O)(=O)C(F)(F)F- InChIKey
SOSKORWAHKKSLI-UHFFFAOYSA-N- Molecular formula
- C6H3F3N2O5S
- Average molar mass
- 272.16 g/mol
- Monoisotopic mass
- 271.97147686
Names & identifiers
- Preferred name
- 2-Nitropyridin-3-yl trifluoromethanesulfonate
- IUPAC
- (2-nitro-3-pyridinyl) trifluoromethanesulfonate
Names & synonyms
146336-72-32-nitropyridin-3-yl trifluoromethanesulfonate2-nitro-3-(trifluoromethylsulfonyloxy)pyridine2-nitropyridin-3-yltrifluoromethanesulfonateSCHEMBL527357WFA33672DB-1824182-nitropyridin-3-yl trifluoro-methanesulfonateEN300-134652
Database identifiers
- PubChem CID
- 10880225
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 110 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 384
Related reactions
2 records
Compound notes
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