(1,1,2,2,3,3-hexafluoro-3-fluorosulfonylpropyl)sulfonyl-(trifluoromethylsulfonyl)azanide

C4F10NO6S3- — CID 58852788

IUPAC(1,1,2,2,3,3-hexafluoro-3-fluorosulfonylpropyl)sulfonyl-(trifluoromethylsulfonyl)azanide
SMILESO=S(=O)(F)C(F)(F)C(F)(F)C(F)(F)S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F
InChIInChI=1S/C4F10NO6S3/c5-1(6,2(7,8)22(14,16)17)3(9,10)23(18,19)15-24(20,21)4(11,12)13/q-1
InChIKeyWMUSEMCLXYTAFZ-UHFFFAOYSA-N
MW444.23 g/mol
LogP1.66
Rot. Bonds6

About (1,1,2,2,3,3-hexafluoro-3-fluorosulfonylpropyl)sulfonyl-(trifluoromethylsulfonyl)azanide

(1,1,2,2,3,3-hexafluoro-3-fluorosulfonylpropyl)sulfonyl-(trifluoromethylsulfonyl)azanide (PubChem CID 58852788) has the molecular formula C4F10NO6S3- and a molecular weight of 444.23 g/mol. Its IUPAC name is (1,1,2,2,3,3-hexafluoro-3-fluorosulfonylpropyl)sulfonyl-(trifluoromethylsulfonyl)azanide.

Molecular Properties

Compound Name(1,1,2,2,3,3-hexafluoro-3-fluorosulfonylpropyl)sulfonyl-(trifluoromethylsulfonyl)azanide
PubChem CID58852788
Molecular FormulaC4F10NO6S3-
Molecular Weight444.23 g/mol
Exact Mass443.87
IUPAC Name(1,1,2,2,3,3-hexafluoro-3-fluorosulfonylpropyl)sulfonyl-(trifluoromethylsulfonyl)azanide
SMILESO=S(=O)(F)C(F)(F)C(F)(F)C(F)(F)S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F
InChIInChI=1S/C4F10NO6S3/c5-1(6,2(7,8)22(14,16)17)3(9,10)23(18,19)15-24(20,21)4(11,12)13/q-1
InChIKeyWMUSEMCLXYTAFZ-UHFFFAOYSA-N
XLogP1.66
TPSA116.52 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500444.23
LogP ≤ 51.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

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Related Compounds

Potassium bis(nonafluorobutanesulfonyl)imide
CID 11319533
1,1,2,2,3,3,4,4,4-Nonafluoro-N-((1,1,2,2,3,3,4,4,4-nonafluorobutyl)sulfonyl)-1-butanesulfonamide
CID 10211210
Ethanesulfonamide, 1,1,2,2,2-pentafluoro-N-[(pentafluoroethyl)sulfonyl]-
CID 2779028
Ethanesulfonamide, 1,1,2,2,2-pentafluoro-N-((1,1,2,2,2-pentafluoroethyl)sulfonyl)-, lithium salt (1:1)
CID 12096715
Lithium Bis(1,1,2,2,3,3,4,4,4-nonafluoro-1-butanesulfonyl)imide
CID 14876273
Bis(1,1,2,2,3,3,3-heptafluoro-1-propanesulfonyl)imide
CID 12167909
Octafluorobutane-1,4-disulfonamide
CID 11631855
Nonafluorobutylsulfonyl(trifluoromethylsulfonyl)amine
CID 11048287
Perfluoro-N-[(trifluoromethyl)sulfonyl]butanesulfonamide sodium salt
CID 138396263
Bis(perfluoroethylsulfonyl)imide
CID 4067273
1,1,2,2,3,3-Hexafluoro-3-(trifluoromethylsulfamoyl)propane-1-sulfonyl fluoride
CID 58519956
1,1,2,2,3,3,3-heptafluoro-N-(trifluoromethylsulfonyl)propane-1-sulfonamide
CID 59703058

Frequently Asked Questions

What is the IUPAC name of (1,1,2,2,3,3-hexafluoro-3-fluorosulfonylpropyl)sulfonyl-(trifluoromethylsulfonyl)azanide?
The IUPAC name of (1,1,2,2,3,3-hexafluoro-3-fluorosulfonylpropyl)sulfonyl-(trifluoromethylsulfonyl)azanide (CID 58852788) is (1,1,2,2,3,3-hexafluoro-3-fluorosulfonylpropyl)sulfonyl-(trifluoromethylsulfonyl)azanide.
What is the SMILES notation for (1,1,2,2,3,3-hexafluoro-3-fluorosulfonylpropyl)sulfonyl-(trifluoromethylsulfonyl)azanide?
The canonical SMILES for (1,1,2,2,3,3-hexafluoro-3-fluorosulfonylpropyl)sulfonyl-(trifluoromethylsulfonyl)azanide is O=S(=O)(F)C(F)(F)C(F)(F)C(F)(F)S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F.
What is the InChIKey of (1,1,2,2,3,3-hexafluoro-3-fluorosulfonylpropyl)sulfonyl-(trifluoromethylsulfonyl)azanide?
The InChIKey is WMUSEMCLXYTAFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C4F10NO6S3/c5-1(6,2(7,8)22(14,16)17)3(9,10)23(18,19)15-24(20,21)4(11,12)13/q-1.
What are the key properties of (1,1,2,2,3,3-hexafluoro-3-fluorosulfonylpropyl)sulfonyl-(trifluoromethylsulfonyl)azanide?
(1,1,2,2,3,3-hexafluoro-3-fluorosulfonylpropyl)sulfonyl-(trifluoromethylsulfonyl)azanide has a molecular weight of 444.23 g/mol, XLogP of 1.66, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (1,1,2,2,3,3-hexafluoro-3-fluorosulfonylpropyl)sulfonyl-(trifluoromethylsulfonyl)azanide is sourced from PubChem (CID 58852788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).