disodium;tris(dioxido(oxo)silane);zirconium(4+);dihydrate

H4Na2O11Si3Zr — CID 173159011

IUPACdisodium;tris(dioxido(oxo)silane);zirconium(4+);dihydrate
SMILESO.O.O=[Si]([O-])[O-].O=[Si]([O-])[O-].O=[Si]([O-])[O-].[Na+].[Na+].[Zr+4]
InChIInChI=1S/2Na.3O3Si.2H2O.Zr/c;;3*1-4(2)3;;;/h;;;;;2*1H2;/q2*+1;3*-2;;;+4
InChIKeyGXGMZDOYUYIGLG-UHFFFAOYSA-N
MW401.48 g/mol
LogP-16.28
Rot. Bonds

About disodium;tris(dioxido(oxo)silane);zirconium(4+);dihydrate

disodium;tris(dioxido(oxo)silane);zirconium(4+);dihydrate (PubChem CID 173159011) has the molecular formula H4Na2O11Si3Zr and a molecular weight of 401.48 g/mol. Its IUPAC name is disodium;tris(dioxido(oxo)silane);zirconium(4+);dihydrate.

Molecular Properties

Compound Namedisodium;tris(dioxido(oxo)silane);zirconium(4+);dihydrate
PubChem CID173159011
Molecular FormulaH4Na2O11Si3Zr
Molecular Weight401.48 g/mol
Exact Mass399.79
IUPAC Namedisodium;tris(dioxido(oxo)silane);zirconium(4+);dihydrate
SMILESO.O.O=[Si]([O-])[O-].O=[Si]([O-])[O-].O=[Si]([O-])[O-].[Na+].[Na+].[Zr+4]
InChIInChI=1S/2Na.3O3Si.2H2O.Zr/c;;3*1-4(2)3;;;/h;;;;;2*1H2;/q2*+1;3*-2;;;+4
InChIKeyGXGMZDOYUYIGLG-UHFFFAOYSA-N
XLogP-16.28
TPSA252.57 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500401.48
LogP ≤ 5-16.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

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bis(arsenic(3+));tris(dioxido(oxo)silane)
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dioxido(oxo)silane;rhodium(2+)
CID 19598913
dioxido(oxo)silane;niobium(2+)
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Frequently Asked Questions

What is the IUPAC name of disodium;tris(dioxido(oxo)silane);zirconium(4+);dihydrate?
The IUPAC name of disodium;tris(dioxido(oxo)silane);zirconium(4+);dihydrate (CID 173159011) is disodium;tris(dioxido(oxo)silane);zirconium(4+);dihydrate.
What is the SMILES notation for disodium;tris(dioxido(oxo)silane);zirconium(4+);dihydrate?
The canonical SMILES for disodium;tris(dioxido(oxo)silane);zirconium(4+);dihydrate is O.O.O=[Si]([O-])[O-].O=[Si]([O-])[O-].O=[Si]([O-])[O-].[Na+].[Na+].[Zr+4].
What is the InChIKey of disodium;tris(dioxido(oxo)silane);zirconium(4+);dihydrate?
The InChIKey is GXGMZDOYUYIGLG-UHFFFAOYSA-N. The full InChI is InChI=1S/2Na.3O3Si.2H2O.Zr/c;;3*1-4(2)3;;;/h;;;;;2*1H2;/q2*+1;3*-2;;;+4.
What are the key properties of disodium;tris(dioxido(oxo)silane);zirconium(4+);dihydrate?
disodium;tris(dioxido(oxo)silane);zirconium(4+);dihydrate has a molecular weight of 401.48 g/mol, XLogP of -16.28, 0 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for disodium;tris(dioxido(oxo)silane);zirconium(4+);dihydrate is sourced from PubChem (CID 173159011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).