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1-(2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-pentadecafluorooctyl)pyridin-1-ium;trifluoromethanesulfonate

1-(2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-pentadecafluorooctyl)pyridin-1-ium;trifluoromethanesulfonate structure

CAS No:
25061-59-0
Formula:
C14H7F18NO3S
Chemical Name:
1-(2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-pentadecafluorooctyl)pyridin-1-ium;trifluoromethanesulfonate
Synonyms:
25061-59-0;N-(1,1-Dihydroperfluorooctyl)pyridinium trifluoromethanesulfonate;Pyridinium, 1-(2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-pentadecafluorooctyl)-, trifluoromethanesulfonate;1-(2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-Pentadecafluorooctyl)pyridinium trifluoromethanesulfonate;MBR 3092-42;DTXSID50179755

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1-(2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-pentadecafluorooctyl)pyridin-1-ium;trifluoromethanesulfonate Basic Attributes

Molecular Weight：

611.25 g/mol

Exact Mass：

610.9859212 g/mol

DSSTox ID：

DTXSID50179755

Characteristics

PSA：

69.5 Å²

1-(2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-pentadecafluorooctyl)pyridin-1-ium;trifluoromethanesulfonate Use and Manufacturing

Use Classification：

PFAS (per- and polyfluoroalkyl substances) -> OECD Category

Computed Properties

Molecular Weight:611.25
Hydrogen Bond Acceptor Count:21
Rotatable Bond Count:7
Exact Mass:610.9859212
Monoisotopic Mass:610.9859212
Topological Polar Surface Area:69.5
Heavy Atom Count:37
Complexity:718
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes

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Guide of 1-(2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-pentadecafluorooctyl)pyridin-1-ium;trifluoromethanesulfonate

Basic Attributes
Characteristics
Use and Manufacturing
Computed Properties

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