sulfuryl difluoride;1,1,1,2,2,3,3,4,4,5,5,6,6,6-tetradecafluorohexane

C6F16O2S — CID 22590239

IUPACsulfuryl difluoride;1,1,1,2,2,3,3,4,4,5,5,6,6,6-tetradecafluorohexane
SMILESFC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F.O=S(=O)(F)F
InChIInChI=1S/C6F14.F2O2S/c7-1(8,3(11,12)5(15,16)17)2(9,10)4(13,14)6(18,19)20;1-5(2,3)4
InChIKeyPHQZNRUCCJYEDD-UHFFFAOYSA-N
MW440.10 g/mol
LogP4.82
Rot. Bonds3

About sulfuryl difluoride;1,1,1,2,2,3,3,4,4,5,5,6,6,6-tetradecafluorohexane

sulfuryl difluoride;1,1,1,2,2,3,3,4,4,5,5,6,6,6-tetradecafluorohexane (PubChem CID 22590239) has the molecular formula C6F16O2S and a molecular weight of 440.10 g/mol. Its IUPAC name is sulfuryl difluoride;1,1,1,2,2,3,3,4,4,5,5,6,6,6-tetradecafluorohexane.

Molecular Properties

Compound Namesulfuryl difluoride;1,1,1,2,2,3,3,4,4,5,5,6,6,6-tetradecafluorohexane
PubChem CID22590239
Molecular FormulaC6F16O2S
Molecular Weight440.10 g/mol
Exact Mass439.94
IUPAC Namesulfuryl difluoride;1,1,1,2,2,3,3,4,4,5,5,6,6,6-tetradecafluorohexane
SMILESFC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F.O=S(=O)(F)F
InChIInChI=1S/C6F14.F2O2S/c7-1(8,3(11,12)5(15,16)17)2(9,10)4(13,14)6(18,19)20;1-5(2,3)4
InChIKeyPHQZNRUCCJYEDD-UHFFFAOYSA-N
XLogP4.82
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500440.10
LogP ≤ 54.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 sulfuryl difluoride;1,1,1,2,2,3,3,4,4,5,5,6,6,6-tetradecafluorohexane?
The IUPAC name of sulfuryl difluoride;1,1,1,2,2,3,3,4,4,5,5,6,6,6-tetradecafluorohexane (CID 22590239) is sulfuryl difluoride;1,1,1,2,2,3,3,4,4,5,5,6,6,6-tetradecafluorohexane.
What is the SMILES notation for sulfuryl difluoride;1,1,1,2,2,3,3,4,4,5,5,6,6,6-tetradecafluorohexane?
The canonical SMILES for sulfuryl difluoride;1,1,1,2,2,3,3,4,4,5,5,6,6,6-tetradecafluorohexane is FC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F.O=S(=O)(F)F.
What is the InChIKey of sulfuryl difluoride;1,1,1,2,2,3,3,4,4,5,5,6,6,6-tetradecafluorohexane?
The InChIKey is PHQZNRUCCJYEDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C6F14.F2O2S/c7-1(8,3(11,12)5(15,16)17)2(9,10)4(13,14)6(18,19)20;1-5(2,3)4.
What are the key properties of sulfuryl difluoride;1,1,1,2,2,3,3,4,4,5,5,6,6,6-tetradecafluorohexane?
sulfuryl difluoride;1,1,1,2,2,3,3,4,4,5,5,6,6,6-tetradecafluorohexane has a molecular weight of 440.10 g/mol, XLogP of 4.82, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for sulfuryl difluoride;1,1,1,2,2,3,3,4,4,5,5,6,6,6-tetradecafluorohexane is sourced from PubChem (CID 22590239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).