lithium;hydride;bis(1,1,2,2-tetrafluoroethane-1,2-disulfonyl fluoride)

C4HF12LiO8S4 — CID 173049005

IUPAClithium;hydride;bis(1,1,2,2-tetrafluoroethane-1,2-disulfonyl fluoride)
SMILESO=S(=O)(F)C(F)(F)C(F)(F)S(=O)(=O)F.O=S(=O)(F)C(F)(F)C(F)(F)S(=O)(=O)F.[H-].[Li+]
InChIInChI=1S/2C2F6O4S2.Li.H/c2*3-1(4,13(7,9)10)2(5,6)14(8,11)12;;/q;;+1;-1
InChIKeyUCQNHEUMZQOWLS-UHFFFAOYSA-N
MW540.23 g/mol
LogP-1.34
Rot. Bonds6

About lithium;hydride;bis(1,1,2,2-tetrafluoroethane-1,2-disulfonyl fluoride)

lithium;hydride;bis(1,1,2,2-tetrafluoroethane-1,2-disulfonyl fluoride) (PubChem CID 173049005) has the molecular formula C4HF12LiO8S4 and a molecular weight of 540.23 g/mol. Its IUPAC name is lithium;hydride;bis(1,1,2,2-tetrafluoroethane-1,2-disulfonyl fluoride).

Molecular Properties

Compound Namelithium;hydride;bis(1,1,2,2-tetrafluoroethane-1,2-disulfonyl fluoride)
PubChem CID173049005
Molecular FormulaC4HF12LiO8S4
Molecular Weight540.23 g/mol
Exact Mass539.85
IUPAC Namelithium;hydride;bis(1,1,2,2-tetrafluoroethane-1,2-disulfonyl fluoride)
SMILESO=S(=O)(F)C(F)(F)C(F)(F)S(=O)(=O)F.O=S(=O)(F)C(F)(F)C(F)(F)S(=O)(=O)F.[H-].[Li+]
InChIInChI=1S/2C2F6O4S2.Li.H/c2*3-1(4,13(7,9)10)2(5,6)14(8,11)12;;/q;;+1;-1
InChIKeyUCQNHEUMZQOWLS-UHFFFAOYSA-N
XLogP-1.34
TPSA136.56 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500540.23
LogP ≤ 5-1.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

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

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Related Compounds

1,1,2,2-tetrafluoro-2-fluorosulfonylethanesulfonic acid
CID 15135176
1,1,2,2-tetrafluoro-2-iodoethanesulfonyl fluoride
CID 19898065
azane;1,1,2,2,3,3,4,4,4-nonafluorobutane-1-sulfonyl fluoride;dihydrofluoride
CID 175311052
cesium 1,1,2,2,3,3-hexafluoro-3-fluorosulfonylpropane-1-sulfonate
CID 23676032
potassium 1,1,2,2,3,3-hexafluoro-3-fluorosulfonylpropane-1-sulfonate
CID 23676030
1,1,2,2,3,3-hexafluoro-3-(trifluoromethoxy)propane-1-sulfonyl fluoride
CID 165365650
1,1,2,2-tetrafluoro-2-(2,3,3-trifluorooxiran-2-yl)ethanesulfonyl fluoride
CID 169224044
1,1,2,2-tetrafluoro-2-[1,1,1,2,3,3-hexafluoro-3-(1,1,1,2,3,3,3-heptafluoropropan-2-yloxy)propan-2-yl]oxyethanesulfonyl fluoride
CID 14687568
lithium;hydride;1,1,2,2,2-pentafluoroethanesulfonic acid
CID 173036129
1,1,2,2,3,3,4,4-octafluoro-4-(trifluoromethylsulfonylsulfamoyl)butane-1-sulfonyl fluoride
CID 58852815
1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,12,12,12-tricosafluorododecane-1-sulfonyl fluoride
CID 89466590
2-(1,2-dichloro-1,2,2-trifluoroethoxy)-1,1,2,2-tetrafluoroethanesulfonyl fluoride
CID 11360103

Frequently Asked Questions

What is the IUPAC name of lithium;hydride;bis(1,1,2,2-tetrafluoroethane-1,2-disulfonyl fluoride)?
The IUPAC name of lithium;hydride;bis(1,1,2,2-tetrafluoroethane-1,2-disulfonyl fluoride) (CID 173049005) is lithium;hydride;bis(1,1,2,2-tetrafluoroethane-1,2-disulfonyl fluoride).
What is the SMILES notation for lithium;hydride;bis(1,1,2,2-tetrafluoroethane-1,2-disulfonyl fluoride)?
The canonical SMILES for lithium;hydride;bis(1,1,2,2-tetrafluoroethane-1,2-disulfonyl fluoride) is O=S(=O)(F)C(F)(F)C(F)(F)S(=O)(=O)F.O=S(=O)(F)C(F)(F)C(F)(F)S(=O)(=O)F.[H-].[Li+].
What is the InChIKey of lithium;hydride;bis(1,1,2,2-tetrafluoroethane-1,2-disulfonyl fluoride)?
The InChIKey is UCQNHEUMZQOWLS-UHFFFAOYSA-N. The full InChI is InChI=1S/2C2F6O4S2.Li.H/c2*3-1(4,13(7,9)10)2(5,6)14(8,11)12;;/q;;+1;-1.
What are the key properties of lithium;hydride;bis(1,1,2,2-tetrafluoroethane-1,2-disulfonyl fluoride)?
lithium;hydride;bis(1,1,2,2-tetrafluoroethane-1,2-disulfonyl fluoride) has a molecular weight of 540.23 g/mol, XLogP of -1.34, 6 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for lithium;hydride;bis(1,1,2,2-tetrafluoroethane-1,2-disulfonyl fluoride) is sourced from PubChem (CID 173049005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).