Basic information
- Standard SMILES
COC(=O)C(C)(CCC(F)(F)C(F)(F)F)S(=O)(=O)CCC(F)(F)C(F)(F)C(F)(F)F- InChIKey
FSHRJHJGFJRRID-UHFFFAOYSA-N- Molecular formula
- C13H14F12O4S
- Average molar mass
- 494.3 g/mol
Names & identifiers
- Preferred name
- Methyl 5,5,6,6,6-pentafluoro-2-(3,3,4,4,5,5,5-heptafluoropentylsulfonyl)-2-methylhexanoate
- IUPAC
- methyl 5,5,6,6,6-pentafluoro-2-(3,3,4,4,5,5,5-heptafluoropentylsulfonyl)-2-methylhexanoate
Names & synonyms
SCHEMBL2431580FSHRJHJGFJRRID-UHFFFAOYSA-Nmethyl 5,5,6,6,6-pentafluoro-2-(3,3,4,4,5,5,5-heptafluoropentylsulfonyl)-2-methylhexanoate
Database identifiers
- PubChem CID
- 57788366
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 68.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 16
- Rotatable bonds
- 10
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 720
Related reactions
1 records
Linked notes
Loading…