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

C4F10NO4S2- — CID 58519955

IUPAC(1,1,2,2,3,3-hexafluoro-3-fluorosulfonylpropyl)sulfonyl-(trifluoromethyl)azanide
SMILESO=S(=O)(F)C(F)(F)C(F)(F)C(F)(F)S(=O)(=O)[N-]C(F)(F)F
InChIInChI=1S/C4F10NO4S2/c5-1(6,2(7,8)20(14,16)17)3(9,10)21(18,19)15-4(11,12)13/q-1
InChIKeyRSOCWBRFPCMAMJ-UHFFFAOYSA-N
MW380.16 g/mol
LogP2.33
Rot. Bonds5

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

(1,1,2,2,3,3-hexafluoro-3-fluorosulfonylpropyl)sulfonyl-(trifluoromethyl)azanide (PubChem CID 58519955) has the molecular formula C4F10NO4S2- and a molecular weight of 380.16 g/mol. Its IUPAC name is (1,1,2,2,3,3-hexafluoro-3-fluorosulfonylpropyl)sulfonyl-(trifluoromethyl)azanide.

Molecular Properties

Compound Name(1,1,2,2,3,3-hexafluoro-3-fluorosulfonylpropyl)sulfonyl-(trifluoromethyl)azanide
PubChem CID58519955
Molecular FormulaC4F10NO4S2-
Molecular Weight380.16 g/mol
Exact Mass379.91
IUPAC Name(1,1,2,2,3,3-hexafluoro-3-fluorosulfonylpropyl)sulfonyl-(trifluoromethyl)azanide
SMILESO=S(=O)(F)C(F)(F)C(F)(F)C(F)(F)S(=O)(=O)[N-]C(F)(F)F
InChIInChI=1S/C4F10NO4S2/c5-1(6,2(7,8)20(14,16)17)3(9,10)21(18,19)15-4(11,12)13/q-1
InChIKeyRSOCWBRFPCMAMJ-UHFFFAOYSA-N
XLogP2.33
TPSA82.38 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.16
LogP ≤ 52.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N-C-halo', 'substructure': 'N/A'}, {'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
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
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
Lithium bis(1,1,2,2,3,3,3-heptafluoro-1-propanesulfonyl)imide
CID 87691590
Sodium Bis(nonafluorobutanesulfonyl)imide
CID 10930074
1,1,2,2,3,3,4,4-Octafluoro-1,4-butanedisulfonyl difluoride
CID 14384436

Frequently Asked Questions

What is the IUPAC name of (1,1,2,2,3,3-hexafluoro-3-fluorosulfonylpropyl)sulfonyl-(trifluoromethyl)azanide?
The IUPAC name of (1,1,2,2,3,3-hexafluoro-3-fluorosulfonylpropyl)sulfonyl-(trifluoromethyl)azanide (CID 58519955) is (1,1,2,2,3,3-hexafluoro-3-fluorosulfonylpropyl)sulfonyl-(trifluoromethyl)azanide.
What is the SMILES notation for (1,1,2,2,3,3-hexafluoro-3-fluorosulfonylpropyl)sulfonyl-(trifluoromethyl)azanide?
The canonical SMILES for (1,1,2,2,3,3-hexafluoro-3-fluorosulfonylpropyl)sulfonyl-(trifluoromethyl)azanide is O=S(=O)(F)C(F)(F)C(F)(F)C(F)(F)S(=O)(=O)[N-]C(F)(F)F.
What is the InChIKey of (1,1,2,2,3,3-hexafluoro-3-fluorosulfonylpropyl)sulfonyl-(trifluoromethyl)azanide?
The InChIKey is RSOCWBRFPCMAMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C4F10NO4S2/c5-1(6,2(7,8)20(14,16)17)3(9,10)21(18,19)15-4(11,12)13/q-1.
What are the key properties of (1,1,2,2,3,3-hexafluoro-3-fluorosulfonylpropyl)sulfonyl-(trifluoromethyl)azanide?
(1,1,2,2,3,3-hexafluoro-3-fluorosulfonylpropyl)sulfonyl-(trifluoromethyl)azanide has a molecular weight of 380.16 g/mol, XLogP of 2.33, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1,1,2,2,3,3-hexafluoro-3-fluorosulfonylpropyl)sulfonyl-(trifluoromethyl)azanide is sourced from PubChem (CID 58519955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).