Basic information
- CAS
647-29-0- Standard SMILES
O=S(O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F- InChIKey
DFCYBFLXCKGZML-UHFFFAOYSA-N- Molecular formula
- C8F17SO2H
- Average molar mass
- 484.13 g/mol
- Monoisotopic mass
- 483.9425792
Names & identifiers
- Preferred name
- Perfluorooctanesulfinic acid
- IUPAC
- 1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctane-1-sulfinic acid
Names & synonyms
perfluorooctanesulfinic acidDTXSID10904262647-29-0RefChem:1094619DTXCID001982141,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctane-1-sulfinic AcidPFOSyAheptadecafluorooctane-1-sulfinic acidPFOSIPFLSiA n=8perfluorooctane sulfinateSCHEMBL2672617
Show more names
DFCYBFLXCKGZML-UHFFFAOYSA-NNS00011413
Database identifiers
- CAS
647-29-0- PubChem CID
- 110548
- DTXSID
DTXSID10904262- Nikkaji
- J2.137.194G
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 56.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 20
- Rotatable bonds
- 7
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 619
Experimental & physicochemical properties
PFAS
PFAS -> Other/unspecified
PFAS -> Other/unspecified
PFAS
PFAS -> Other/unspecified
PFAS -> Perfluoroalkyl acids (PFAAs)
PFAS (Perfluoroalkyl (linear) sulfinate, n=8)
Chemistry & industry
Uses & manufacturing
Uses• Processing aid [Ref: CAS2019 (WO9702300)]
Use ClassificationPFAS (Perfluoroalkyl (linear) sulfinate, n=8)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…