N-(2-Hydroxyethyl)perfluoro(2,5-dimethyl-3,6-dioxanonan)amide
Basic information
- CAS
137506-19-5- Standard SMILES
O=C(NCCO)C(F)(OC(F)(F)C(F)(OC(F)(F)C(F)(F)C(F)(F)F)C(F)(F)F)C(F)(F)F- InChIKey
LENQWYBQXKARDJ-UHFFFAOYSA-N- Molecular formula
- C11H6F17NO4
- Average molar mass
- 539.14 g/mol
- Monoisotopic mass
- 539.0025364
Names & identifiers
- Preferred name
- N-(2-Hydroxyethyl)perfluoro(2,5-dimethyl-3,6-dioxanonan)amide
- IUPAC
- 2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propoxy]-N-(2-hydroxyethyl)propanamide
- English name
- 2,3,3,3-Tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propoxy]-N-(2-hydroxyethyl)propanamide
- Molecular formula
- C11H6F17NO4
- Molecular weight
- 539.14
Names & synonyms
137506-19-5N-(2-Hydroxyethyl)perfluoro(2,5-dimethyl-3,6-dioxanonan)amide2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propoxy]-N-(2-hydroxyethyl)propanamideN-(2-Hydroxyethyl)perfluoro-(2,5-dimethyl-3,6-dioxanonan)amide2,3,3,3-Tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(heptafluoropropoxy)propoxy]-N-(2-hydroxyethyl)propanamideC11H6F17NO4DTXSID40896545MFCD00319424AKOS007930678NS00110464N-(2-hydroxyethyl)-perfluoro-2,5-dimethyl-3,6-dioxa-nonanamidePropanamide, 2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propoxy]-N-(2-hydroxyethyl)-
Database identifiers
- CAS
137506-19-5- PubChem CID
- 56587795
- DTXSID
DTXSID40896545
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 67.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 21
- Rotatable bonds
- 9
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 701
Experimental & physicochemical properties
PFAS
PFAS -> OECD Category
PFAS -> Other/unspecified
Physicochemical properties
- Boiling point
- 341.3 · 341.3±42.0 °C(Predicted)
- Density
- 1.688 · 1.688±0.06 g/cm3(Predicted)
- pka
- 10.69 · 10.69±0.46(Predicted)
- EPA Substance Registry System
- 2 · 2,3,3,3-Tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(heptafluoropropoxy)propoxy]-N-(2-hydroxyethyl)propanamide (137506-19-5)
- HS Code
- 2922390090 · 2922390090
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hs_code
- 2922390090
Chemistry & industry
Uses & manufacturing
Use ClassificationPFAS (per- and polyfluoroalkyl substances) -> OECD Category
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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