1-Nonanesulfonyl fluoride, 1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-nonadecafluoro-
Basic information
- CAS
68259-06-3- Standard SMILES
O=S(=O)(F)C(F)(F)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
NBFKXQZHVNHRSB-UHFFFAOYSA-N- Molecular formula
- C9F20O2S
- Average molar mass
- 552.13 g/mol
- Monoisotopic mass
- 551.9299637
Names & identifiers
- Preferred name
- 1-Nonanesulfonyl fluoride, 1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-nonadecafluoro-
- IUPAC
- 1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-nonadecafluorononane-1-sulfonyl fluoride
- English name
- perfluorononanesulphonyl fluoride
- Molecular formula
- C9F20O2S
- Molecular weight
- 552.13
Names & synonyms
Nonadecafluorononanesulfonyl fluorideEINECS 269-509-51-Nonanesulfonyl fluoride, 1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-nonadecafluoro-RefChem:43508468259-06-3perfluorononanesulfonyl fluoridePerfluorononanesulphonyl fluorideNonadecafluorononane-1-sulfonyl fluorideSCHEMBL585308DTXSID3071351NS000112581,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-Nonadecafluoro-1-nonanesulfonic acid fluoride
Database identifiers
- CAS
68259-06-3- PubChem CID
- 109945
- DTXSID
DTXSID3071351- EC Number
- 269-509-5
- Nikkaji
- J289.107G
Properties
Computed structural properties
- XLogP
- 6.7
- Topological polar surface area
- 42.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 22
- Rotatable bonds
- 8
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 813
Experimental & physicochemical properties
PFAS
PFAS -> Other/unspecified
PFAS -> OECD Category
PFAS -> Other/unspecified
Physicochemical properties
- EPA Substance Registry System
- 1 · 1-Nonanesulfonyl fluoride, 1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-nonadecafluoro- (68259-06-3)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Regulatory InformationS - indicates a substance that is identified in a final Significant New Use Rule.
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
Use ClassificationPFAS (per- and polyfluoroalkyl substances) -> OECD Category
General Manufacturing Information1-Nonanesulfonyl fluoride, 1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-nonadecafluoro-: INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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