Basic information
- Standard SMILES
CC(C)(C)c1ccc([I+]c2ccc(C(C)(C)C)cc2)cc1.O=S(=O)([O-])CC(O)(C(F)(F)F)C(F)(F)F- InChIKey
ZBGMPEXWQIRRKB-UHFFFAOYSA-M- Molecular formula
- C24H29F6IO4S
- Average molar mass
- 654.4 g/mol
Names & identifiers
- Preferred name
- Bis(4-tert-butylphenyl)iodonium 3,3,3-trifluoro-2-hydroxy-2-trifluoromethylpropane-1-sulfonate
- IUPAC
- bis(4-tert-butylphenyl)iodanium;3,3,3-trifluoro-2-hydroxy-2-(trifluoromethyl)propane-1-sulfonate
Names & synonyms
bis(4-tert-butylphenyl)iodonium 3,3,3-trifluoro-2-hydroxy-2-trifluoromethylpropane-1-sulfonateSCHEMBL3794342
Database identifiers
- PubChem CID
- 86644258
Properties
Computed structural properties
- Topological polar surface area
- 85.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 5
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 565
Related reactions
2 records
Compound notes
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