triphenoxy(sulfanylidene)-λ5-stibane

C18H15O3SSb — CID 22724594

IUPACtriphenoxy(sulfanylidene)-λ5-stibane
SMILESS=[Sb](Oc1ccccc1)(Oc1ccccc1)Oc1ccccc1
InChIInChI=1S/3C6H6O.S.Sb/c3*7-6-4-2-1-3-5-6;;/h3*1-5,7H;;/q;;;;+3/p-3
InChIKeyKKEMIWABSCXSLG-UHFFFAOYSA-K
MW433.14 g/mol
LogP4.86
Rot. Bonds6

About triphenoxy(sulfanylidene)-λ5-stibane

triphenoxy(sulfanylidene)-λ5-stibane (PubChem CID 22724594) has the molecular formula C18H15O3SSb and a molecular weight of 433.14 g/mol. Its IUPAC name is triphenoxy(sulfanylidene)-λ5-stibane.

Molecular Properties

Compound Nametriphenoxy(sulfanylidene)-λ5-stibane
PubChem CID22724594
Molecular FormulaC18H15O3SSb
Molecular Weight433.14 g/mol
Exact Mass431.98
IUPAC Nametriphenoxy(sulfanylidene)-λ5-stibane
SMILESS=[Sb](Oc1ccccc1)(Oc1ccccc1)Oc1ccccc1
InChIInChI=1S/3C6H6O.S.Sb/c3*7-6-4-2-1-3-5-6;;/h3*1-5,7H;;/q;;;;+3/p-3
InChIKeyKKEMIWABSCXSLG-UHFFFAOYSA-K
XLogP4.86
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500433.14
LogP ≤ 54.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of triphenoxy(sulfanylidene)-λ5-stibane?
The IUPAC name of triphenoxy(sulfanylidene)-λ5-stibane (CID 22724594) is triphenoxy(sulfanylidene)-λ5-stibane.
What is the SMILES notation for triphenoxy(sulfanylidene)-λ5-stibane?
The canonical SMILES for triphenoxy(sulfanylidene)-λ5-stibane is S=[Sb](Oc1ccccc1)(Oc1ccccc1)Oc1ccccc1.
What is the InChIKey of triphenoxy(sulfanylidene)-λ5-stibane?
The InChIKey is KKEMIWABSCXSLG-UHFFFAOYSA-K. The full InChI is InChI=1S/3C6H6O.S.Sb/c3*7-6-4-2-1-3-5-6;;/h3*1-5,7H;;/q;;;;+3/p-3.
What are the key properties of triphenoxy(sulfanylidene)-λ5-stibane?
triphenoxy(sulfanylidene)-λ5-stibane has a molecular weight of 433.14 g/mol, XLogP of 4.86, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for triphenoxy(sulfanylidene)-λ5-stibane is sourced from PubChem (CID 22724594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).