pentafluoro(phenoxy)-λ6-sulfane

C6H5F5OS — CID 23237526

IUPACpentafluoro(phenoxy)-λ6-sulfane
SMILESFS(F)(F)(F)(F)Oc1ccccc1
InChIInChI=1S/C6H5F5OS/c7-13(8,9,10,11)12-6-4-2-1-3-5-6/h1-5H
InChIKeyWEEBTAGBRGSOKI-UHFFFAOYSA-N
MW220.16 g/mol
LogP4.28
Rot. Bonds2

About pentafluoro(phenoxy)-λ6-sulfane

pentafluoro(phenoxy)-λ6-sulfane (PubChem CID 23237526) has the molecular formula C6H5F5OS and a molecular weight of 220.16 g/mol. Its IUPAC name is pentafluoro(phenoxy)-λ6-sulfane.

Molecular Properties

Compound Namepentafluoro(phenoxy)-λ6-sulfane
PubChem CID23237526
Molecular FormulaC6H5F5OS
Molecular Weight220.16 g/mol
Exact Mass220.00
IUPAC Namepentafluoro(phenoxy)-λ6-sulfane
SMILESFS(F)(F)(F)(F)Oc1ccccc1
InChIInChI=1S/C6H5F5OS/c7-13(8,9,10,11)12-6-4-2-1-3-5-6/h1-5H
InChIKeyWEEBTAGBRGSOKI-UHFFFAOYSA-N
XLogP4.28
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.16
LogP ≤ 54.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of pentafluoro(phenoxy)-λ6-sulfane?
The IUPAC name of pentafluoro(phenoxy)-λ6-sulfane (CID 23237526) is pentafluoro(phenoxy)-λ6-sulfane.
What is the SMILES notation for pentafluoro(phenoxy)-λ6-sulfane?
The canonical SMILES for pentafluoro(phenoxy)-λ6-sulfane is FS(F)(F)(F)(F)Oc1ccccc1.
What is the InChIKey of pentafluoro(phenoxy)-λ6-sulfane?
The InChIKey is WEEBTAGBRGSOKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5F5OS/c7-13(8,9,10,11)12-6-4-2-1-3-5-6/h1-5H.
What are the key properties of pentafluoro(phenoxy)-λ6-sulfane?
pentafluoro(phenoxy)-λ6-sulfane has a molecular weight of 220.16 g/mol, XLogP of 4.28, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for pentafluoro(phenoxy)-λ6-sulfane is sourced from PubChem (CID 23237526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).