Basic information
- CAS
153580-03-1- Standard SMILES
CC1(C)CCC=C1OS(=O)(=O)C(F)(F)F- InChIKey
SEAXRDLUZSGVKL-UHFFFAOYSA-N- Molecular formula
- C8H11F3O3S
- Average molar mass
- 244.23 g/mol
- Monoisotopic mass
- 244.03809987
Names & identifiers
- Preferred name
- 5,5-Dimethyl-1-cyclopenten-1-yl 1,1,1-trifluoromethanesulfonate
- IUPAC
- (5,5-dimethylcyclopenten-1-yl) trifluoromethanesulfonate
Names & synonyms
153580-03-15,5-Dimethyl-1-cyclopenten-1-yl 1,1,1-trifluoromethanesulfonateRefChem:2983285,5-dimethylcyclopent-1-en-1-yl trifluoromethanesulfonate5,5-dimethyl-1-cyclopentenyl trifluoromethanesulfonateSCHEMBL1584611DTXSID901173142DB-4132915,5-dimethylcyclopent-1-enyl trifluoromethanesulfonatetrifluoro-methanesulfonic acid 5,5-dimethyl-cyclopent-1-enyl estertrifluoromethanesulfonic acid 5,5-dimethyl-cyclopent-1-enyl ester
Database identifiers
- CAS
153580-03-1- PubChem CID
- 10243533
- DTXSID
DTXSID901173142
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 51.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 373
Related reactions
4 records
Compound notes
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