magnesium;zinc;cerium(3+);oxido(oxo)alumane

Al7CeMgO14Zn — CID 18421140

IUPACmagnesium;zinc;cerium(3+);oxido(oxo)alumane
SMILESO=[Al][O-].O=[Al][O-].O=[Al][O-].O=[Al][O-].O=[Al][O-].O=[Al][O-].O=[Al][O-].[Ce+3].[Mg+2].[Zn+2]
InChIInChI=1S/7Al.Ce.Mg.14O.Zn/q;;;;;;;+3;+2;;;;;;;;7*-1;+2
InChIKeyWEIPYAZOUMDOOO-UHFFFAOYSA-N
MW642.67 g/mol
LogP-12.20
Rot. Bonds

About magnesium;zinc;cerium(3+);oxido(oxo)alumane

magnesium;zinc;cerium(3+);oxido(oxo)alumane (PubChem CID 18421140) has the molecular formula Al7CeMgO14Zn and a molecular weight of 642.67 g/mol. Its IUPAC name is magnesium;zinc;cerium(3+);oxido(oxo)alumane.

Molecular Properties

Compound Namemagnesium;zinc;cerium(3+);oxido(oxo)alumane
PubChem CID18421140
Molecular FormulaAl7CeMgO14Zn
Molecular Weight642.67 g/mol
Exact Mass640.62
IUPAC Namemagnesium;zinc;cerium(3+);oxido(oxo)alumane
SMILESO=[Al][O-].O=[Al][O-].O=[Al][O-].O=[Al][O-].O=[Al][O-].O=[Al][O-].O=[Al][O-].[Ce+3].[Mg+2].[Zn+2]
InChIInChI=1S/7Al.Ce.Mg.14O.Zn/q;;;;;;;+3;+2;;;;;;;;7*-1;+2
InChIKeyWEIPYAZOUMDOOO-UHFFFAOYSA-N
XLogP-12.20
TPSA280.91 Ų
H-Bond Donors
H-Bond Acceptors14
Rotatable Bonds
Heavy Atoms24
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500642.67
LogP ≤ 5-12.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1014

Computed Properties (RDKit)

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

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Related Compounds

magnesium;oxido(oxo)alumane;chloride
CID 173490224
zinc;lead(2+);oxido(oxo)alumane
CID 173454246
magnesium;strontium;hydride;neodymium;oxido(oxo)alumane
CID 173370533
CID 173350853
CID 173350853
calcium;oxido(oxo)alumane;chloride
CID 173490225
dilithium;oxido(oxo)alumane;chloride
CID 173012456
aluminum;oxido(oxo)alumane;silane
CID 173346752
lithium;sodium;oxido(oxo)alumane
CID 173306647
sodium;hydron;oxido(oxo)alumane
CID 173397924
sodium;oxido(oxo)alumane;hydrate
CID 23711517
cesium;potassium;hydride;oxido(oxo)alumane
CID 173317123
aluminum;dioxido(oxo)silane;oxido(oxo)alumane
CID 173416886

Frequently Asked Questions

What is the IUPAC name of magnesium;zinc;cerium(3+);oxido(oxo)alumane?
The IUPAC name of magnesium;zinc;cerium(3+);oxido(oxo)alumane (CID 18421140) is magnesium;zinc;cerium(3+);oxido(oxo)alumane.
What is the SMILES notation for magnesium;zinc;cerium(3+);oxido(oxo)alumane?
The canonical SMILES for magnesium;zinc;cerium(3+);oxido(oxo)alumane is O=[Al][O-].O=[Al][O-].O=[Al][O-].O=[Al][O-].O=[Al][O-].O=[Al][O-].O=[Al][O-].[Ce+3].[Mg+2].[Zn+2].
What is the InChIKey of magnesium;zinc;cerium(3+);oxido(oxo)alumane?
The InChIKey is WEIPYAZOUMDOOO-UHFFFAOYSA-N. The full InChI is InChI=1S/7Al.Ce.Mg.14O.Zn/q;;;;;;;+3;+2;;;;;;;;7*-1;+2.
What are the key properties of magnesium;zinc;cerium(3+);oxido(oxo)alumane?
magnesium;zinc;cerium(3+);oxido(oxo)alumane has a molecular weight of 642.67 g/mol, XLogP of -12.20, 0 rotatable bonds, 0 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for magnesium;zinc;cerium(3+);oxido(oxo)alumane is sourced from PubChem (CID 18421140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).