CID 170839343

H2AlMgO4Si-2 — CID 170839343

IUPAC—
SMILESO.O=[Si]([O-])[O-].[Al].[Mg]
InChIInChI=1S/Al.Mg.O3Si.H2O/c;;1-4(2)3;/h;;;1H2/q;;-2;
InChIKeyCKTCSVVEMZTDGC-UHFFFAOYSA-N
MW145.38 g/mol
LogP-4.46
Rot. Bonds

About CID 170839343

CID 170839343 (PubChem CID 170839343) has the molecular formula H2AlMgO4Si-2 and a molecular weight of 145.38 g/mol.

Molecular Properties

Compound NameCID 170839343
PubChem CID170839343
Molecular FormulaH2AlMgO4Si-2
Molecular Weight145.38 g/mol
Exact Mass144.94
IUPAC Name—
SMILESO.O=[Si]([O-])[O-].[Al].[Mg]
InChIInChI=1S/Al.Mg.O3Si.H2O/c;;1-4(2)3;/h;;;1H2/q;;-2;
InChIKeyCKTCSVVEMZTDGC-UHFFFAOYSA-N
XLogP-4.46
TPSA94.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.38
LogP ≤ 5-4.46
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 170839343?
The IUPAC name of CID 170839343 (CID 170839343) is not available.
What is the SMILES notation for CID 170839343?
The canonical SMILES for CID 170839343 is O.O=[Si]([O-])[O-].[Al].[Mg].
What is the InChIKey of CID 170839343?
The InChIKey is CKTCSVVEMZTDGC-UHFFFAOYSA-N. The full InChI is InChI=1S/Al.Mg.O3Si.H2O/c;;1-4(2)3;/h;;;1H2/q;;-2;.
What are the key properties of CID 170839343?
CID 170839343 has a molecular weight of 145.38 g/mol, XLogP of -4.46, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 170839343 is sourced from PubChem (CID 170839343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).