Basic information
- CAS
16486-94-5- Standard SMILES
O=C(O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(C(F)(F)F)C(F)(F)F- InChIKey
FTUYMACVNWCLNM-UHFFFAOYSA-N- Molecular formula
- C11HF21O2
- Average molar mass
- 564.09 g/mol
- Monoisotopic mass
- 563.9641207
Names & identifiers
- Preferred name
- Decanoic acid, 2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,10,10,10-octadecafluoro-9-(trifluoromethyl)-
- IUPAC
- 2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,10,10,10-octadecafluoro-9-(trifluoromethyl)decanoic acid
- English name
- octadecafluoro-9-(trifluoromethyl)decanoic acid
- Molecular formula
- C11HF21O2
- Molecular weight
- 564.09
Names & synonyms
Decanoic acid, 2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,10,10,10-octadecafluoro-9-(trifluoromethyl)-RefChem:585472Octadecafluoro-9-(trifluoromethyl)decanoic acid16486-94-52,2,3,3,4,4,5,5,6,6,7,7,8,8,9,10,10,10-octadecafluoro-9-(trifluoromethyl)decanoic acidPerfluoro-9-(trifluoromethyl)decanoic acidEINECS 240-544-8B7NW4ZMV4PDecanoic acid, octadecafluoro-9-(trifluoromethyl)-DTXSID7066063SCHEMBL11584806NS00011267
Database identifiers
- CAS
16486-94-5- PubChem CID
- 85448
- DTXSID
DTXSID7066063- UNII
- B7NW4ZMV4P
- EC Number
- 240-544-8
- Nikkaji
- J283.084A
Properties
Computed structural properties
- XLogP
- 6.9
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 23
- Rotatable bonds
- 8
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 772
Experimental & physicochemical properties
PFAS
PFAS -> Other/unspecified
PFAS -> OECD Category
PFAS -> Other/unspecified
PFAS -> Other/unspecified
Physicochemical properties
- EPA Substance Registry System
- -9 · Octadecafluoro-9-(trifluoromethyl)decanoic acid (16486-94-5)
- 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 InformationDecanoic acid, 2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,10,10,10-octadecafluoro-9-(trifluoromethyl)-: INACTIVE
Suppliers1 total
泰州市众致生物科技有限公司[email protected] 15066129350 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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