lithium bis(2,2,2-trifluoroethoxysulfonyl)azanide

C4H4F6LiNO6S2 — CID 59957277

IUPAClithium bis(2,2,2-trifluoroethoxysulfonyl)azanide
SMILESO=S(=O)([N-]S(=O)(=O)OCC(F)(F)F)OCC(F)(F)F.[Li+]
InChIInChI=1S/C4H4F6NO6S2.Li/c5-3(6,7)1-16-18(12,13)11-19(14,15)17-2-4(8,9)10;/h1-2H2;/q-1;+1
InChIKeyLIQYDYKWISBASX-UHFFFAOYSA-N
MW347.14 g/mol
LogP-1.99
Rot. Bonds6

About lithium bis(2,2,2-trifluoroethoxysulfonyl)azanide

lithium bis(2,2,2-trifluoroethoxysulfonyl)azanide (PubChem CID 59957277) has the molecular formula C4H4F6LiNO6S2 and a molecular weight of 347.14 g/mol. Its IUPAC name is lithium bis(2,2,2-trifluoroethoxysulfonyl)azanide.

Molecular Properties

Compound Namelithium bis(2,2,2-trifluoroethoxysulfonyl)azanide
PubChem CID59957277
Molecular FormulaC4H4F6LiNO6S2
Molecular Weight347.14 g/mol
Exact Mass346.95
IUPAC Namelithium bis(2,2,2-trifluoroethoxysulfonyl)azanide
SMILESO=S(=O)([N-]S(=O)(=O)OCC(F)(F)F)OCC(F)(F)F.[Li+]
InChIInChI=1S/C4H4F6NO6S2.Li/c5-3(6,7)1-16-18(12,13)11-19(14,15)17-2-4(8,9)10;/h1-2H2;/q-1;+1
InChIKeyLIQYDYKWISBASX-UHFFFAOYSA-N
XLogP-1.99
TPSA100.84 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.14
LogP ≤ 5-1.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

2,2'-[Iminobis(sulfonyloxy)]bis(1,1,1-trifluoroethane)
CID 15510308
2,2,3,3,3-pentafluoropropyl N-(2,2,3,3,3-pentafluoropropoxysulfonyl)sulfamate
CID 18003740
3,3'-[Iminobis(sulfonyloxy)]bis(1,1,2,2-tetrafluoropropane)
CID 18003741
Sodium bis(2,2,3,3-tetrafluoropropoxysulfonyl)azanide
CID 59957279
2,2-difluoroethyl N-(2,2-difluoroethoxysulfonyl)sulfamate
CID 138528796
Lithium bis(2,2,3,3-tetrafluoropropoxysulfonyl)azanide
CID 175693845
Lithium bis(2,2,3,3,3-pentafluoropropoxysulfonyl)azanide
CID 175693974
Lithium bis(1,1,1,3,3,3-hexafluoropropan-2-yloxysulfonyl)azanide
CID 15396533
Bis(2,2,2-trifluoroethoxysulfonyl)azanide
CID 102194735
Lithium bis(2,2,2-trifluoroethoxysulfonyloxy)methyl 2,2,2-trifluoroethyl sulfate
CID 177620902

Frequently Asked Questions

What is the IUPAC name of lithium bis(2,2,2-trifluoroethoxysulfonyl)azanide?
The IUPAC name of lithium bis(2,2,2-trifluoroethoxysulfonyl)azanide (CID 59957277) is lithium bis(2,2,2-trifluoroethoxysulfonyl)azanide.
What is the SMILES notation for lithium bis(2,2,2-trifluoroethoxysulfonyl)azanide?
The canonical SMILES for lithium bis(2,2,2-trifluoroethoxysulfonyl)azanide is O=S(=O)([N-]S(=O)(=O)OCC(F)(F)F)OCC(F)(F)F.[Li+].
What is the InChIKey of lithium bis(2,2,2-trifluoroethoxysulfonyl)azanide?
The InChIKey is LIQYDYKWISBASX-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H4F6NO6S2.Li/c5-3(6,7)1-16-18(12,13)11-19(14,15)17-2-4(8,9)10;/h1-2H2;/q-1;+1.
What are the key properties of lithium bis(2,2,2-trifluoroethoxysulfonyl)azanide?
lithium bis(2,2,2-trifluoroethoxysulfonyl)azanide has a molecular weight of 347.14 g/mol, XLogP of -1.99, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for lithium bis(2,2,2-trifluoroethoxysulfonyl)azanide is sourced from PubChem (CID 59957277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).