Basic information
- Standard SMILES
CCCCOC(=O)C(CC)OS(=O)(=O)C(F)(F)F- InChIKey
JYPMAJBCBINWCZ-UHFFFAOYSA-N- Molecular formula
- C9H15F3O5S
- Average molar mass
- 292.27 g/mol
Names & identifiers
- Preferred name
- (S)-2-[(Trifluoromethylsulfonyl)oxy]butanoic acid butyl ester
- IUPAC
- butyl 2-(trifluoromethylsulfonyloxy)butanoate
Names & synonyms
Pemafibrate Impurity 48(S)-2-[(Trifluoromethylsulfonyl)oxy]butanoic acid butyl ester1823707-09-0
Database identifiers
- PubChem CID
- 91032189
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 78.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 8
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 357
Related reactions
2 records
Compound notes
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