aluminum;cerium(3+);pentakis(oxygen(2-));zirconium(4+);hydrate

H2AlCeO6Zr — CID 172792126

IUPACaluminum;cerium(3+);pentakis(oxygen(2-));zirconium(4+);hydrate
SMILESO.[Al+3].[Ce+3].[O-2].[O-2].[O-2].[O-2].[O-2].[Zr+4]
InChIInChI=1S/Al.Ce.H2O.5O.Zr/h;;1H2;;;;;;/q2*+3;;5*-2;+4
InChIKeyPSCQAKMALINKSO-UHFFFAOYSA-N
MW356.33 g/mol
LogP-1.80
Rot. Bonds

About aluminum;cerium(3+);pentakis(oxygen(2-));zirconium(4+);hydrate

aluminum;cerium(3+);pentakis(oxygen(2-));zirconium(4+);hydrate (PubChem CID 172792126) has the molecular formula H2AlCeO6Zr and a molecular weight of 356.33 g/mol. Its IUPAC name is aluminum;cerium(3+);pentakis(oxygen(2-));zirconium(4+);hydrate.

Molecular Properties

Compound Namealuminum;cerium(3+);pentakis(oxygen(2-));zirconium(4+);hydrate
PubChem CID172792126
Molecular FormulaH2AlCeO6Zr
Molecular Weight356.33 g/mol
Exact Mass354.78
IUPAC Namealuminum;cerium(3+);pentakis(oxygen(2-));zirconium(4+);hydrate
SMILESO.[Al+3].[Ce+3].[O-2].[O-2].[O-2].[O-2].[O-2].[Zr+4]
InChIInChI=1S/Al.Ce.H2O.5O.Zr/h;;1H2;;;;;;/q2*+3;;5*-2;+4
InChIKeyPSCQAKMALINKSO-UHFFFAOYSA-N
XLogP-1.80
TPSA174.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms9
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.33
LogP ≤ 5-1.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of aluminum;cerium(3+);pentakis(oxygen(2-));zirconium(4+);hydrate?
The IUPAC name of aluminum;cerium(3+);pentakis(oxygen(2-));zirconium(4+);hydrate (CID 172792126) is aluminum;cerium(3+);pentakis(oxygen(2-));zirconium(4+);hydrate.
What is the SMILES notation for aluminum;cerium(3+);pentakis(oxygen(2-));zirconium(4+);hydrate?
The canonical SMILES for aluminum;cerium(3+);pentakis(oxygen(2-));zirconium(4+);hydrate is O.[Al+3].[Ce+3].[O-2].[O-2].[O-2].[O-2].[O-2].[Zr+4].
What is the InChIKey of aluminum;cerium(3+);pentakis(oxygen(2-));zirconium(4+);hydrate?
The InChIKey is PSCQAKMALINKSO-UHFFFAOYSA-N. The full InChI is InChI=1S/Al.Ce.H2O.5O.Zr/h;;1H2;;;;;;/q2*+3;;5*-2;+4.
What are the key properties of aluminum;cerium(3+);pentakis(oxygen(2-));zirconium(4+);hydrate?
aluminum;cerium(3+);pentakis(oxygen(2-));zirconium(4+);hydrate has a molecular weight of 356.33 g/mol, XLogP of -1.80, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for aluminum;cerium(3+);pentakis(oxygen(2-));zirconium(4+);hydrate is sourced from PubChem (CID 172792126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).