Basic information
- CAS
24924-36-5- Standard SMILES
C=CCN(CC)S(=O)(=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
ALIDKXPAUJUDJU-UHFFFAOYSA-N- Molecular formula
- C13H10F17NO2S
- Average molar mass
- 567.26 g/mol
- Monoisotopic mass
- 567.0160785
Names & identifiers
- Preferred name
- 1-Octanesulfonamide, N-ethyl-1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluoro-N-2-propen-1-yl-
- IUPAC
- N-ethyl-1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluoro-N-prop-2-enyloctane-1-sulfonamide
- English name
- N-allyl-N-ethylheptadecafluorooctanesulphonamide
- Molecular formula
- C13H10F17NO2S
- Molecular weight
- 567.26
Names & synonyms
EINECS 246-533-4N-Allyl-N-ethyl-1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctanesulfonamide1-Octanesulfonamide, N-ethyl-1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluoro-N-2-propen-1-yl-RefChem:435176N-Allyl-N-ethylheptadecafluorooctanesulphonamide24924-36-5N3CX5M43961-Octanesulfonamide, N-ethyl-1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluoro-N-2-propenyl-N-Allyl-N-ethylheptadecafluorooctanesulfonamideN-ethyl-1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluoro-N-prop-2-enyloctane-1-sulfonamideUNII-N3CX5M4396SCHEMBL9561852
Show more names
Reaxys ID: 11885998N-(2-Propenyl)-N-ethyl-1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluoro-1-octanesulfonamide
DTXSID7067033ALIDKXPAUJUDJU-UHFFFAOYSA-NFA90905N-Allyl-N-ethyl-perfluorooctanesulfonamideN-Ethyl-1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluoro-N-(prop-2-en-1-yl)octane-1-sulfonamideNS000113221-OCTANESULPHONAMIDE, N-ETHYL-1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-HEPTADECAFLUORO-N-2-PROPENYL-N-ETHYL-1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-HEPTADECAFLUORO-N-2-PROPEN-1-YL-1-OCTANESULFONAMIDE
Properties
Computed structural properties
- XLogP
- 6.4
- Topological polar surface area
- 45.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 20
- Rotatable bonds
- 11
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 856
Experimental & physicochemical properties
PFAS
PFAS -> Other/unspecified
PFAS -> Other/unspecified
PFAS -> OECD Category
PFAS -> Other/unspecified
Physicochemical properties
- Boiling point
- 291.1 · 291.1±50.0 °C(Predicted)
- Density
- 1.577 · 1.577±0.06 g/cm3(Predicted)
- pka
- -8.08 · -8.08±0.70(Predicted)
- FDA UNII
- 3 CX5M4396 · N3CX5M4396
- EPA Substance Registry System
- 1 · 1-Octanesulfonamide, N-ethyl-1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluoro-N-2-propenyl- (24924-36-5)
- 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-Octanesulfonamide, N-ethyl-1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluoro-N-2-propen-1-yl-: INACTIVE
Upstream & downstream products
Upstream raw materials
Suppliers1 total
HONEST JOY HOLDINGS LIMITED[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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