lanthanum(3+);lead(2+);titanium(4+);zirconium(4+);tridecahydroxide

H13LaO13PbTiZr — CID 71347086

IUPAClanthanum(3+);lead(2+);titanium(4+);zirconium(4+);tridecahydroxide
SMILES[La+3].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[Pb+2].[Ti+4].[Zr+4]
InChIInChI=1S/La.13H2O.Pb.Ti.Zr/h;13*1H2;;;/q+3;;;;;;;;;;;;;;+2;2*+4/p-13
InChIKeyXDSZMLKCJKMNAK-UHFFFAOYSA-A
MW706.29 g/mol
LogP-2.68
Rot. Bonds

About lanthanum(3+);lead(2+);titanium(4+);zirconium(4+);tridecahydroxide

lanthanum(3+);lead(2+);titanium(4+);zirconium(4+);tridecahydroxide (PubChem CID 71347086) has the molecular formula H13LaO13PbTiZr and a molecular weight of 706.29 g/mol. Its IUPAC name is lanthanum(3+);lead(2+);titanium(4+);zirconium(4+);tridecahydroxide.

Molecular Properties

Compound Namelanthanum(3+);lead(2+);titanium(4+);zirconium(4+);tridecahydroxide
PubChem CID71347086
Molecular FormulaH13LaO13PbTiZr
Molecular Weight706.29 g/mol
Exact Mass705.77
IUPAC Namelanthanum(3+);lead(2+);titanium(4+);zirconium(4+);tridecahydroxide
SMILES[La+3].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[Pb+2].[Ti+4].[Zr+4]
InChIInChI=1S/La.13H2O.Pb.Ti.Zr/h;13*1H2;;;/q+3;;;;;;;;;;;;;;+2;2*+4/p-13
InChIKeyXDSZMLKCJKMNAK-UHFFFAOYSA-A
XLogP-2.68
TPSA390.00 Ų
H-Bond Donors
H-Bond Acceptors13
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500706.29
LogP ≤ 5-2.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1013

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Frequently Asked Questions

What is the IUPAC name of lanthanum(3+);lead(2+);titanium(4+);zirconium(4+);tridecahydroxide?
The IUPAC name of lanthanum(3+);lead(2+);titanium(4+);zirconium(4+);tridecahydroxide (CID 71347086) is lanthanum(3+);lead(2+);titanium(4+);zirconium(4+);tridecahydroxide.
What is the SMILES notation for lanthanum(3+);lead(2+);titanium(4+);zirconium(4+);tridecahydroxide?
The canonical SMILES for lanthanum(3+);lead(2+);titanium(4+);zirconium(4+);tridecahydroxide is [La+3].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[Pb+2].[Ti+4].[Zr+4].
What is the InChIKey of lanthanum(3+);lead(2+);titanium(4+);zirconium(4+);tridecahydroxide?
The InChIKey is XDSZMLKCJKMNAK-UHFFFAOYSA-A. The full InChI is InChI=1S/La.13H2O.Pb.Ti.Zr/h;13*1H2;;;/q+3;;;;;;;;;;;;;;+2;2*+4/p-13.
What are the key properties of lanthanum(3+);lead(2+);titanium(4+);zirconium(4+);tridecahydroxide?
lanthanum(3+);lead(2+);titanium(4+);zirconium(4+);tridecahydroxide has a molecular weight of 706.29 g/mol, XLogP of -2.68, 0 rotatable bonds, 0 hydrogen bond donors, and 13 hydrogen bond acceptors.
Where does this data come from?
All data for lanthanum(3+);lead(2+);titanium(4+);zirconium(4+);tridecahydroxide is sourced from PubChem (CID 71347086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).