CID 173373645

H2AlFeMgO4Si — CID 173373645

IUPAC—
SMILESO.O=[Si]([O-])[O-].[Al].[Fe].[Mg+2]
InChIInChI=1S/Al.Fe.Mg.O3Si.H2O/c;;;1-4(2)3;/h;;;;1H2/q;;+2;-2;
InChIKeyGFGHOHSDVWNPDT-UHFFFAOYSA-N
MW201.23 g/mol
LogP-4.47
Rot. Bonds

About CID 173373645

CID 173373645 (PubChem CID 173373645) has the molecular formula H2AlFeMgO4Si and a molecular weight of 201.23 g/mol.

Molecular Properties

Compound NameCID 173373645
PubChem CID173373645
Molecular FormulaH2AlFeMgO4Si
Molecular Weight201.23 g/mol
Exact Mass200.87
IUPAC Name—
SMILESO.O=[Si]([O-])[O-].[Al].[Fe].[Mg+2]
InChIInChI=1S/Al.Fe.Mg.O3Si.H2O/c;;;1-4(2)3;/h;;;;1H2/q;;+2;-2;
InChIKeyGFGHOHSDVWNPDT-UHFFFAOYSA-N
XLogP-4.47
TPSA94.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.23
LogP ≤ 5-4.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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 CID 173373645?
The IUPAC name of CID 173373645 (CID 173373645) is not available.
What is the SMILES notation for CID 173373645?
The canonical SMILES for CID 173373645 is O.O=[Si]([O-])[O-].[Al].[Fe].[Mg+2].
What is the InChIKey of CID 173373645?
The InChIKey is GFGHOHSDVWNPDT-UHFFFAOYSA-N. The full InChI is InChI=1S/Al.Fe.Mg.O3Si.H2O/c;;;1-4(2)3;/h;;;;1H2/q;;+2;-2;.
What are the key properties of CID 173373645?
CID 173373645 has a molecular weight of 201.23 g/mol, XLogP of -4.47, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 173373645 is sourced from PubChem (CID 173373645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).