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[2,2,3,3,4,4-Hexafluoro-4-(fluoroformyl)butyramido]sulfur pentafluoride

HCID 567933
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Basic information

CAS
91940-19-1
Standard SMILES
O=C(F)C(F)(F)C(F)(F)C(F)(F)C(=O)NS(F)(F)(F)(F)F
InChIKey
VZCADLSVUKTBNJ-UHFFFAOYSA-N
Molecular formula
C5HF12NO2S
Average molar mass
367.11 g/mol
Monoisotopic mass
366.9536374

Names & identifiers

Preferred name
[2,2,3,3,4,4-Hexafluoro-4-(fluoroformyl)butyramido]sulfur pentafluoride
IUPAC
2,2,3,3,4,4-hexafluoro-5-oxo-5-[(pentafluoro-λ6-sulfanyl)amino]pentanoyl fluoride

Names & synonyms

VZCADLSVUKTBNJ-UHFFFAOYSA-NDTXSID201353692[2,2,3,3,4,4-Hexafluoro-4-(fluoroformyl)butyramido]sulfur pentafluoride[4-(Fluoroformyl)perfluorobutyramido]sulfur pentafluoride91940-19-1

Database identifiers

CAS
91940-19-1
PubChem CID
567933
DTXSID
DTXSID201353692
Nikkaji
J596.996D

Properties

Computed structural properties

XLogP
5.2
Topological polar surface area
47.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
14
Rotatable bonds
4
Heavy atoms
21
Formal charge
0
Complexity
479

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Compound notes

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