Basic information
- Standard SMILES
CC(C)(C)C(=O)C[S+]1CCCC1.O=S(=O)([O-])C(F)(F)C(F)(F)C(F)(F)C(F)(F)F- InChIKey
VEDMEFJCRKXOCA-UHFFFAOYSA-M- Molecular formula
- C14H19F9O4S2
- Average molar mass
- 486.4 g/mol
Names & identifiers
- Preferred name
- 2-Oxo-3,3-dimethylbutyl-thiacyclopentanium nonafluorobutanesulfonate
- IUPAC
- 3,3-dimethyl-1-(thiolan-1-ium-1-yl)butan-2-one;1,1,2,2,3,3,4,4,4-nonafluorobutane-1-sulfonate
Names & synonyms
2-oxo-3,3-dimethylbutyl-thiacyclopentanium nonafluorobutanesulfonateSCHEMBL44925492-oxo-3,3-dimethylbutyltetrahydrothiophenium perfluorobutanesulfonate2-oxo-3,3-dimethylbutyltetrahydro-thiophenium perfluorobutanesulfonate
Database identifiers
- PubChem CID
- 22564587
Properties
Computed structural properties
- Topological polar surface area
- 83.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 13
- Rotatable bonds
- 5
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 537
Related reactions
3 records
Linked notes
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