aluminum;magnesium;iron;oxygen(2-);zinc;silicate;hydrate

H2AlFeMgO6SiZn- — CID 3081423

IUPACaluminum;magnesium;iron;oxygen(2-);zinc;silicate;hydrate
SMILESO.[Al+3].[Fe].[Mg+2].[O-2].[O-][Si]([O-])([O-])[O-].[Zn]
InChIInChI=1S/Al.Fe.Mg.O4Si.H2O.O.Zn/c;;;1-5(2,3)4;;;/h;;;;1H2;;/q+3;;+2;-4;;-2;
InChIKeyZSVTXBUFFFWLNW-UHFFFAOYSA-N
MW298.62 g/mol
LogP-6.85
Rot. Bonds

About aluminum;magnesium;iron;oxygen(2-);zinc;silicate;hydrate

aluminum;magnesium;iron;oxygen(2-);zinc;silicate;hydrate (PubChem CID 3081423) has the molecular formula H2AlFeMgO6SiZn- and a molecular weight of 298.62 g/mol. Its IUPAC name is aluminum;magnesium;iron;oxygen(2-);zinc;silicate;hydrate.

Molecular Properties

Compound Namealuminum;magnesium;iron;oxygen(2-);zinc;silicate;hydrate
PubChem CID3081423
Molecular FormulaH2AlFeMgO6SiZn-
Molecular Weight298.62 g/mol
Exact Mass296.79
IUPAC Namealuminum;magnesium;iron;oxygen(2-);zinc;silicate;hydrate
SMILESO.[Al+3].[Fe].[Mg+2].[O-2].[O-][Si]([O-])([O-])[O-].[Zn]
InChIInChI=1S/Al.Fe.Mg.O4Si.H2O.O.Zn/c;;;1-5(2,3)4;;;/h;;;;1H2;;/q+3;;+2;-4;;-2;
InChIKeyZSVTXBUFFFWLNW-UHFFFAOYSA-N
XLogP-6.85
TPSA152.24 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.62
LogP ≤ 5-6.85
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 aluminum;magnesium;iron;oxygen(2-);zinc;silicate;hydrate?
The IUPAC name of aluminum;magnesium;iron;oxygen(2-);zinc;silicate;hydrate (CID 3081423) is aluminum;magnesium;iron;oxygen(2-);zinc;silicate;hydrate.
What is the SMILES notation for aluminum;magnesium;iron;oxygen(2-);zinc;silicate;hydrate?
The canonical SMILES for aluminum;magnesium;iron;oxygen(2-);zinc;silicate;hydrate is O.[Al+3].[Fe].[Mg+2].[O-2].[O-][Si]([O-])([O-])[O-].[Zn].
What is the InChIKey of aluminum;magnesium;iron;oxygen(2-);zinc;silicate;hydrate?
The InChIKey is ZSVTXBUFFFWLNW-UHFFFAOYSA-N. The full InChI is InChI=1S/Al.Fe.Mg.O4Si.H2O.O.Zn/c;;;1-5(2,3)4;;;/h;;;;1H2;;/q+3;;+2;-4;;-2;.
What are the key properties of aluminum;magnesium;iron;oxygen(2-);zinc;silicate;hydrate?
aluminum;magnesium;iron;oxygen(2-);zinc;silicate;hydrate has a molecular weight of 298.62 g/mol, XLogP of -6.85, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for aluminum;magnesium;iron;oxygen(2-);zinc;silicate;hydrate is sourced from PubChem (CID 3081423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).