2,2,3,3,4,4,4-Heptafluoro-N-(2-methylpropyl)butanamide

HCID 534742

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Basic information

CAS: 75668-25-6
Standard SMILES: CC(C)CNC(=O)C(F)(F)C(F)(F)C(F)(F)F
InChIKey: HWSOCRJXRIBNPB-UHFFFAOYSA-N
Molecular formula: C8H10F7NO
Average molar mass: 269.16 g/mol
Monoisotopic mass: 269.06506108

Names & identifiers

Preferred name: 2,2,3,3,4,4,4-Heptafluoro-N-(2-methylpropyl)butanamide
IUPAC: 2,2,3,3,4,4,4-heptafluoro-N-(2-methylpropyl)butanamide

Names & synonyms

2,2,3,3,4,4,4-heptafluoro-N-(2-methylpropyl)butanamideDTXSID3089574475668-25-6RefChem:242596DTXCID201325257N-(2-Methylpropyl)heptafluorobutyramideSCHEMBL8933058HWSOCRJXRIBNPB-UHFFFAOYSA-NAKOS003791511NS001100602,2,3,3,4,4,4-Heptafluoro-N-isobutylbutanamide #

Database identifiers

CAS: 75668-25-6
PubChem CID: 534742
DTXSID: DTXSID30895744

Properties

Computed structural properties

XLogP: 3.3
Topological polar surface area: 29.1 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 8
Rotatable bonds: 4
Heavy atoms: 17
Formal charge: 0
Complexity: 284

Experimental & physicochemical properties

PFAS · 2 items

PFAS -> Other/unspecified

PFAS -> OECD Category

Chemistry & industry

Uses & manufacturing

Use ClassificationPFAS (per- and polyfluoroalkyl substances) -> OECD Category

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Compound notes

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