hexafluoroantimony(1-);(4-methoxyphenyl)-diphenylsulfanium

C19H17F6OSSb — CID 16705462

IUPAChexafluoroantimony(1-);(4-methoxyphenyl)-diphenylsulfanium
SMILESCOc1ccc([S+](c2ccccc2)c2ccccc2)cc1.F[Sb-](F)(F)(F)(F)F
InChIInChI=1S/C19H17OS.6FH.Sb/c1-20-16-12-14-19(15-13-16)21(17-8-4-2-5-9-17)18-10-6-3-7-11-18;;;;;;;/h2-15H,1H3;6*1H;/q+1;;;;;;;+5/p-6
InChIKeyWICFCHPTTKAXHO-UHFFFAOYSA-H
MW529.16 g/mol
LogP6.93
Rot. Bonds4

About hexafluoroantimony(1-);(4-methoxyphenyl)-diphenylsulfanium

hexafluoroantimony(1-);(4-methoxyphenyl)-diphenylsulfanium (PubChem CID 16705462) has the molecular formula C19H17F6OSSb and a molecular weight of 529.16 g/mol. Its IUPAC name is hexafluoroantimony(1-);(4-methoxyphenyl)-diphenylsulfanium.

Molecular Properties

Compound Namehexafluoroantimony(1-);(4-methoxyphenyl)-diphenylsulfanium
PubChem CID16705462
Molecular FormulaC19H17F6OSSb
Molecular Weight529.16 g/mol
Exact Mass527.99
IUPAC Namehexafluoroantimony(1-);(4-methoxyphenyl)-diphenylsulfanium
SMILESCOc1ccc([S+](c2ccccc2)c2ccccc2)cc1.F[Sb-](F)(F)(F)(F)F
InChIInChI=1S/C19H17OS.6FH.Sb/c1-20-16-12-14-19(15-13-16)21(17-8-4-2-5-9-17)18-10-6-3-7-11-18;;;;;;;/h2-15H,1H3;6*1H;/q+1;;;;;;;+5/p-6
InChIKeyWICFCHPTTKAXHO-UHFFFAOYSA-H
XLogP6.93
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500529.16
LogP ≤ 56.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of hexafluoroantimony(1-);(4-methoxyphenyl)-diphenylsulfanium?
The IUPAC name of hexafluoroantimony(1-);(4-methoxyphenyl)-diphenylsulfanium (CID 16705462) is hexafluoroantimony(1-);(4-methoxyphenyl)-diphenylsulfanium.
What is the SMILES notation for hexafluoroantimony(1-);(4-methoxyphenyl)-diphenylsulfanium?
The canonical SMILES for hexafluoroantimony(1-);(4-methoxyphenyl)-diphenylsulfanium is COc1ccc([S+](c2ccccc2)c2ccccc2)cc1.F[Sb-](F)(F)(F)(F)F.
What is the InChIKey of hexafluoroantimony(1-);(4-methoxyphenyl)-diphenylsulfanium?
The InChIKey is WICFCHPTTKAXHO-UHFFFAOYSA-H. The full InChI is InChI=1S/C19H17OS.6FH.Sb/c1-20-16-12-14-19(15-13-16)21(17-8-4-2-5-9-17)18-10-6-3-7-11-18;;;;;;;/h2-15H,1H3;6*1H;/q+1;;;;;;;+5/p-6.
What are the key properties of hexafluoroantimony(1-);(4-methoxyphenyl)-diphenylsulfanium?
hexafluoroantimony(1-);(4-methoxyphenyl)-diphenylsulfanium has a molecular weight of 529.16 g/mol, XLogP of 6.93, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for hexafluoroantimony(1-);(4-methoxyphenyl)-diphenylsulfanium is sourced from PubChem (CID 16705462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).