Basic information
- CAS
66008-68-2- Standard SMILES
C=CC(=O)OCCN(C)S(=O)(=O)CC(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)C(F)(F)F- InChIKey
XGSOKOQKZXARCB-UHFFFAOYSA-N- Molecular formula
- C17H12F21NO4S
- Average molar mass
- 725.3 g/mol
- Monoisotopic mass
- 725.0151704
Names & identifiers
- Preferred name
- 2-Propenoic acid, 2-[[(2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-eicosafluoroundecyl)sulfonyl]methylamino]ethyl ester
- IUPAC
- 2-[2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-henicosafluoroundecylsulfonyl(methyl)amino]ethyl prop-2-enoate
- English name
- 2-[[(2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-icosafluoroundecyl)sulphonyl]methylamino]ethyl acrylate
- Molecular formula
- C17H12F21NO4S
- Molecular weight
- 725.31
Names & synonyms
2-(N-(1,1-Dihydroperfluoroundecylsulfonyl)-N-methylamino)ethyl acrylateEINECS 266-059-1Acrylic acid, 2-(N-(1,1-dihydroperfluoroundecysulfonyl)-N-methylamino)ethyl ester2-[N-(1,1-Dihydroperfluoroundecylsulfonyl)-N-methylamino]ethyl acrylate2-Propenoic acid, 2-(((2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-eicosafluoroundecyl)sulfonyl)methylamino)ethyl ester2-Propenoic acid, 2-[[(2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-eicosafluoroundecyl)sulfonyl]methylamino]ethyl esterRefChem:47914066008-68-2DTXSID4070376NS000110592-(((2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-Icosafluoroundecyl)sulphonyl)methylamino)ethyl acrylate2-((2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-henicosafluoro-N-methylundecyl)sulfonamido)ethyl acrylate
Show more names
2-[[(2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-icosafluoroundecyl)sulphonyl]methylamino]ethyl acrylatePropenoic acid 2-[[(2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-henicosafluoroundecyl)sulfonyl](methyl)amino]ethyl ester
Properties
Computed structural properties
- XLogP
- 7.1
- Topological polar surface area
- 72.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 26
- Rotatable bonds
- 16
- Heavy atoms
- 44
- Formal charge
- 0
- Complexity
- 1,170
Experimental & physicochemical properties
PFAS
PFAS -> Other/unspecified
PFAS -> OECD Category
PFAS -> Other/unspecified
PFAS -> Other/unspecified
Physicochemical properties
- EPA Substance Registry System
- 2 · 2-[N-(1,1-Dihydroperfluoroundecylsulfonyl)-N-methylamino]ethyl acrylate (66008-68-2)
- 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 Information2-Propenoic acid, 2-[[(2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-eicosafluoroundecyl)sulfonyl]methylamino]ethyl ester: INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…