1,1,2,2-tetrafluoroethylsulfonyl 1,1,2,2-tetrafluoroethanesulfonate

C4H2F8O5S2 — CID 24775313

IUPAC1,1,2,2-tetrafluoroethylsulfonyl 1,1,2,2-tetrafluoroethanesulfonate
SMILESO=S(=O)(OS(=O)(=O)C(F)(F)C(F)F)C(F)(F)C(F)F
InChIInChI=1S/C4H2F8O5S2/c5-1(6)3(9,10)18(13,14)17-19(15,16)4(11,12)2(7)8/h1-2H
InChIKeyABDHAXFOQSHSGZ-UHFFFAOYSA-N
MW346.17 g/mol
LogP1.38
Rot. Bonds6

About 1,1,2,2-tetrafluoroethylsulfonyl 1,1,2,2-tetrafluoroethanesulfonate

1,1,2,2-tetrafluoroethylsulfonyl 1,1,2,2-tetrafluoroethanesulfonate (PubChem CID 24775313) has the molecular formula C4H2F8O5S2 and a molecular weight of 346.17 g/mol. Its IUPAC name is 1,1,2,2-tetrafluoroethylsulfonyl 1,1,2,2-tetrafluoroethanesulfonate.

Molecular Properties

Compound Name1,1,2,2-tetrafluoroethylsulfonyl 1,1,2,2-tetrafluoroethanesulfonate
PubChem CID24775313
Molecular FormulaC4H2F8O5S2
Molecular Weight346.17 g/mol
Exact Mass345.92
IUPAC Name1,1,2,2-tetrafluoroethylsulfonyl 1,1,2,2-tetrafluoroethanesulfonate
SMILESO=S(=O)(OS(=O)(=O)C(F)(F)C(F)F)C(F)(F)C(F)F
InChIInChI=1S/C4H2F8O5S2/c5-1(6)3(9,10)18(13,14)17-19(15,16)4(11,12)2(7)8/h1-2H
InChIKeyABDHAXFOQSHSGZ-UHFFFAOYSA-N
XLogP1.38
TPSA77.51 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.17
LogP ≤ 51.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1,1,2,2-tetrafluoroethylsulfonyl 1,1,2,2-tetrafluoroethanesulfonate?
The IUPAC name of 1,1,2,2-tetrafluoroethylsulfonyl 1,1,2,2-tetrafluoroethanesulfonate (CID 24775313) is 1,1,2,2-tetrafluoroethylsulfonyl 1,1,2,2-tetrafluoroethanesulfonate.
What is the SMILES notation for 1,1,2,2-tetrafluoroethylsulfonyl 1,1,2,2-tetrafluoroethanesulfonate?
The canonical SMILES for 1,1,2,2-tetrafluoroethylsulfonyl 1,1,2,2-tetrafluoroethanesulfonate is O=S(=O)(OS(=O)(=O)C(F)(F)C(F)F)C(F)(F)C(F)F.
What is the InChIKey of 1,1,2,2-tetrafluoroethylsulfonyl 1,1,2,2-tetrafluoroethanesulfonate?
The InChIKey is ABDHAXFOQSHSGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H2F8O5S2/c5-1(6)3(9,10)18(13,14)17-19(15,16)4(11,12)2(7)8/h1-2H.
What are the key properties of 1,1,2,2-tetrafluoroethylsulfonyl 1,1,2,2-tetrafluoroethanesulfonate?
1,1,2,2-tetrafluoroethylsulfonyl 1,1,2,2-tetrafluoroethanesulfonate has a molecular weight of 346.17 g/mol, XLogP of 1.38, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,2,2-tetrafluoroethylsulfonyl 1,1,2,2-tetrafluoroethanesulfonate is sourced from PubChem (CID 24775313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).