Basic information
- CAS
755-02-2- Standard SMILES
OCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F- InChIKey
WOBDSRMWHWAQFO-UHFFFAOYSA-N- Molecular formula
- C7F15CH2CH2OH
- Average molar mass
- 414.11 g/mol
- Monoisotopic mass
- 414.0100872
Names & identifiers
- Preferred name
- Fluorotelomer alcohol 7:2
- IUPAC
- 3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-pentadecafluorononan-1-ol
- English name
- 2-(Perfluoro-n-heptyl)ethanol
- Molecular formula
- C9H5F15O
- Molecular weight
- 414.11
Names & synonyms
755-02-2Fluorotelomer alcohol 7:2DTXSID10895328RefChem:1085452DTXCID609159043,3,4,4,5,5,6,6,7,7,8,8,9,9,9-pentadecafluorononan-1-ol2-(PERFLUORO-N-HEPTYL)ETHANOLSCHEMBL4123177SCHEMBL6873310C9 Gamma-Omega Perfluoro AlcoholWOBDSRMWHWAQFO-UHFFFAOYSA-NNS00109329
Show more names
1H,1H,2H,2H-Perfluorononan-1-ol1-Nonanol, 3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-pentadecafluoro-
Database identifiers
- CAS
755-02-2- PubChem CID
- 4456432
- DTXSID
DTXSID10895328- Nikkaji
- J537.809E
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 16
- Rotatable bonds
- 7
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 476
Experimental & physicochemical properties
PFAS
PFAS -> Fluorotelomer based substances
PFAS -> Other/unspecified
PFAS -> OECD Category
Physicochemical properties
- Boiling point
- 84 °C · 84 °C(Press: 10 Torr)
- Density
- 1.613 · 1.613±0.06 g/cm3(Predicted)
- pka
- 14.28 · 14.28±0.10(Predicted)
- EPA Substance Registry System
- 3 · 3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-Pentadecafluorononan-1-ol (755-02-2)
Chemistry & industry
Uses & manufacturing
Use ClassificationPFAS (per- and polyfluoroalkyl substances) -> OECD Category
Suppliers1 total
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Related reactions
0 records
No reaction records under the current filter.
Compound notes
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