dialuminum;silicate

Al2O4Si+2 — CID 158296395

IUPACdialuminum;silicate
SMILES[Al+3].[Al+3].[O-][Si]([O-])([O-])[O-]
InChIInChI=1S/2Al.O4Si/c;;1-5(2,3)4/q2*+3;-4
InChIKeyGLYOXLIJAHXVEY-UHFFFAOYSA-N
MW146.05 g/mol
LogP-5.90
Rot. Bonds

About dialuminum;silicate

dialuminum;silicate (PubChem CID 158296395) has the molecular formula Al2O4Si+2 and a molecular weight of 146.05 g/mol. Its IUPAC name is dialuminum;silicate.

Molecular Properties

Compound Namedialuminum;silicate
PubChem CID158296395
Molecular FormulaAl2O4Si+2
Molecular Weight146.05 g/mol
Exact Mass145.92
IUPAC Namedialuminum;silicate
SMILES[Al+3].[Al+3].[O-][Si]([O-])([O-])[O-]
InChIInChI=1S/2Al.O4Si/c;;1-5(2,3)4/q2*+3;-4
InChIKeyGLYOXLIJAHXVEY-UHFFFAOYSA-N
XLogP-5.90
TPSA92.24 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.05
LogP ≤ 5-5.90
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 dialuminum;silicate?
The IUPAC name of dialuminum;silicate (CID 158296395) is dialuminum;silicate.
What is the SMILES notation for dialuminum;silicate?
The canonical SMILES for dialuminum;silicate is [Al+3].[Al+3].[O-][Si]([O-])([O-])[O-].
What is the InChIKey of dialuminum;silicate?
The InChIKey is GLYOXLIJAHXVEY-UHFFFAOYSA-N. The full InChI is InChI=1S/2Al.O4Si/c;;1-5(2,3)4/q2*+3;-4.
What are the key properties of dialuminum;silicate?
dialuminum;silicate has a molecular weight of 146.05 g/mol, XLogP of -5.90, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for dialuminum;silicate is sourced from PubChem (CID 158296395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).