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914637-49-3

914637-49-3 Structure

914637-49-3 Structure
IdentificationBack Directory
[Name]

4,4,5,5,6,6,7,7,8,8,8-Undecafluorooctanoic acid
[CAS]

914637-49-3
[Synonyms]

4,4,5,5,6,6,7,7,8,8,8-Undecafluorooctanoic acid
Octanoic acid, 4,4,5,5,6,6,7,7,8,8,8-undecafluoro-
[Molecular Formula]

C8H5F11O2
[MDL Number]

MFCD08460490
[MOL File]

914637-49-3.mol
[Molecular Weight]

342.11
Chemical PropertiesBack Directory
[Boiling point ]

199.0±35.0 °C(Predicted)
[density ]

1.588±0.06 g/cm3(Predicted)
[solubility ]

DMF: 5 mg/ml,DMSO: 2 mg/ml,Ethanol: insol,PBS (pH 7.2): insol
[form ]

A solid
[pka]

4.18±0.10(Predicted)
[Major Application]

PFAS testing
clinical testing
coatings
environmental
food and beverages
[InChI]

InChI=1S/C8H5F11O2/c9-4(10,2-1-3(20)21)5(11,12)6(13,14)7(15,16)8(17,18)19/h1-2H2,(H,20,21)
[InChIKey]

ABFCFCPCGMHSRX-UHFFFAOYSA-N
[SMILES]

C(O)(=O)CCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
[EPA Substance Registry System]

5:3 Polyfluorinated acid (914637-49-3)
Safety DataBack Directory
[Symbol(GHS) ]

Corrosion (GHS05)
GHS05
[Signal word ]

Danger
[Hazard statements ]

H314
[Precautionary statements ]

P260-P280
[WGK Germany ]

WGK 3
[HS Code ]

2915907098
[Storage Class]

8A - Combustible corrosive hazardous materials
[Hazard Classifications]

Eye Dam. 1
Skin Corr. 1B
Hazard InformationBack Directory
[Uses]

2H,2H,3H,3H-Perfluorooctanoic Acid is used in analytical studies for the identification of precursors and biodegradable products of perfluorinated and polyflorinated compounds using high resolution mass spectrometry.
[Definition]

ChEBI: 53FTA is a medium-chain fatty acid.
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