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1-Nonanesulfonic acid, 1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-nonadecafluoro-, ammonium salt (1:1)

HCID 86997
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
17202-41-4
Standard SMILES
N.O=S(=O)(O)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
CCLOSADEZDSARB-UHFFFAOYSA-N
Molecular formula
C9HF19O3S.H3N
Average molar mass
567.17 g/mol
Monoisotopic mass
566.9608492

Names & identifiers

Preferred name
1-Nonanesulfonic acid, 1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-nonadecafluoro-, ammonium salt (1:1)
IUPAC
azane;1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-nonadecafluorononane-1-sulfonic acid

Names & synonyms

1-Nonanesulfonic acid, 1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-nonadecafluoro-, ammonium salt (1:1)1-Nonanesulfonic acid, 1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-nonadecafluoro-, ammonium saltRefChem:435082Ammonium nonadecafluorononanesulphonateEINECS 241-247-6Perfluorononanesulfonic acid ammonium saltSCHEMBL3121787azane;1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-nonadecafluorononane-1-sulfonic acid

Database identifiers

CAS
17202-41-4
PubChem CID
86997
EC Number
241-247-6

Properties

Computed structural properties

Topological polar surface area
63.8 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
23
Rotatable bonds
8
Heavy atoms
33
Formal charge
0
Complexity
816

Experimental & physicochemical properties

PFAS · 2 items

PFAS -> non-polymer

PFAS -> OECD Category

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 3 items

Danger

H301: Toxic if swallowed [Danger Acute toxicity, oral]

P203, P260, P263, P264, P270, P280, P301+P316, P318, P319, P321, P330, P405, and P501 (click each P-code to see the statement)

Hazard information

Regulatory Information · 3 items

Chemical: 1-Nonanesulfonic acid, 1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-nonadecafluoro-, ammonium salt

S - indicates a substance that is identified in a final Significant New Use Rule.

1-Nonanesulfonic acid, 1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-nonadecafluoro-, ammonium salt: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.

Other Safety InformationIMAP assessments - Direct precursors to perfluorononanesulfonate (PFNS) and perfluorodecanesulfonate (PFDS): Environment tier II assessment
Hazard Classes and CategoriesAcute toxicity - category 3

Chemistry & industry

Uses & manufacturing

Usesnon-polymer PFAS -> Electroplating -> Chrome plating
Use ClassificationPFAS (per- and polyfluoroalkyl substances) -> OECD Category
General Manufacturing Information1-Nonanesulfonic acid, 1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-nonadecafluoro-, ammonium salt (1:1): ACTIVE

Related reactions

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Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes