2,6-dimethylpyrylium;hexachloroantimony(1-)

C7H9Cl6OSb — CID 44887160

IUPAC2,6-dimethylpyrylium;hexachloroantimony(1-)
SMILESCc1cccc(C)[o+]1.Cl[Sb-](Cl)(Cl)(Cl)(Cl)Cl
InChIInChI=1S/C7H9O.6ClH.Sb/c1-6-4-3-5-7(2)8-6;;;;;;;/h3-5H,1-2H3;6*1H;/q+1;;;;;;;+5/p-6
InChIKeyFEUDVONFEXLNOY-UHFFFAOYSA-H
MW443.63 g/mol
LogP5.93
Rot. Bonds

About 2,6-dimethylpyrylium;hexachloroantimony(1-)

2,6-dimethylpyrylium;hexachloroantimony(1-) (PubChem CID 44887160) has the molecular formula C7H9Cl6OSb and a molecular weight of 443.63 g/mol. Its IUPAC name is 2,6-dimethylpyrylium;hexachloroantimony(1-).

Molecular Properties

Compound Name2,6-dimethylpyrylium;hexachloroantimony(1-)
PubChem CID44887160
Molecular FormulaC7H9Cl6OSb
Molecular Weight443.63 g/mol
Exact Mass439.78
IUPAC Name2,6-dimethylpyrylium;hexachloroantimony(1-)
SMILESCc1cccc(C)[o+]1.Cl[Sb-](Cl)(Cl)(Cl)(Cl)Cl
InChIInChI=1S/C7H9O.6ClH.Sb/c1-6-4-3-5-7(2)8-6;;;;;;;/h3-5H,1-2H3;6*1H;/q+1;;;;;;;+5/p-6
InChIKeyFEUDVONFEXLNOY-UHFFFAOYSA-H
XLogP5.93
TPSA11.30 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500443.63
LogP ≤ 55.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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 2,6-dimethylpyrylium;hexachloroantimony(1-)?
The IUPAC name of 2,6-dimethylpyrylium;hexachloroantimony(1-) (CID 44887160) is 2,6-dimethylpyrylium;hexachloroantimony(1-).
What is the SMILES notation for 2,6-dimethylpyrylium;hexachloroantimony(1-)?
The canonical SMILES for 2,6-dimethylpyrylium;hexachloroantimony(1-) is Cc1cccc(C)[o+]1.Cl[Sb-](Cl)(Cl)(Cl)(Cl)Cl.
What is the InChIKey of 2,6-dimethylpyrylium;hexachloroantimony(1-)?
The InChIKey is FEUDVONFEXLNOY-UHFFFAOYSA-H. The full InChI is InChI=1S/C7H9O.6ClH.Sb/c1-6-4-3-5-7(2)8-6;;;;;;;/h3-5H,1-2H3;6*1H;/q+1;;;;;;;+5/p-6.
What are the key properties of 2,6-dimethylpyrylium;hexachloroantimony(1-)?
2,6-dimethylpyrylium;hexachloroantimony(1-) has a molecular weight of 443.63 g/mol, XLogP of 5.93, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethylpyrylium;hexachloroantimony(1-) is sourced from PubChem (CID 44887160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).