aluminum;zinc;hydrogen phosphate;phosphate

HAlO8P2Zn — CID 159394914

IUPACaluminum;zinc;hydrogen phosphate;phosphate
SMILESO=P([O-])([O-])O.O=P([O-])([O-])[O-].[Al+3].[Zn+2]
InChIInChI=1S/Al.2H3O4P.Zn/c;2*1-5(2,3)4;/h;2*(H3,1,2,3,4);/q+3;;;+2/p-5
InChIKeyLMOWHKIRCVHUHE-UHFFFAOYSA-I
MW283.32 g/mol
LogP-5.40
Rot. Bonds

About aluminum;zinc;hydrogen phosphate;phosphate

aluminum;zinc;hydrogen phosphate;phosphate (PubChem CID 159394914) has the molecular formula HAlO8P2Zn and a molecular weight of 283.32 g/mol. Its IUPAC name is aluminum;zinc;hydrogen phosphate;phosphate.

Molecular Properties

Compound Namealuminum;zinc;hydrogen phosphate;phosphate
PubChem CID159394914
Molecular FormulaHAlO8P2Zn
Molecular Weight283.32 g/mol
Exact Mass281.83
IUPAC Namealuminum;zinc;hydrogen phosphate;phosphate
SMILESO=P([O-])([O-])O.O=P([O-])([O-])[O-].[Al+3].[Zn+2]
InChIInChI=1S/Al.2H3O4P.Zn/c;2*1-5(2,3)4;/h;2*(H3,1,2,3,4);/q+3;;;+2/p-5
InChIKeyLMOWHKIRCVHUHE-UHFFFAOYSA-I
XLogP-5.40
TPSA169.67 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.32
LogP ≤ 5-5.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

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Related Compounds

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CID 173424288
aluminum;hydrogen phosphate;fluoride
CID 157444743
dialuminum;trisodium;heptakis(dihydrogen phosphate);hydrogen phosphate
CID 138394176
dipotassium;trisodium;hydrogen phosphate;phosphate
CID 22665013
pentasodium;hydrogen phosphate;phosphoric acid;phosphate
CID 158487659
aluminum;sodium;hydrogen phosphate;hydrate
CID 138394889
hydrogen phosphate;bis(lutetium(3+))
CID 159566068
bis(chromium(3+));hydrogen phosphate
CID 19708255
dizinc;tetrakis(dihydrogen phosphate)
CID 161370337
zinc bis(dihydrogen phosphate)
CID 11253952

Frequently Asked Questions

What is the IUPAC name of aluminum;zinc;hydrogen phosphate;phosphate?
The IUPAC name of aluminum;zinc;hydrogen phosphate;phosphate (CID 159394914) is aluminum;zinc;hydrogen phosphate;phosphate.
What is the SMILES notation for aluminum;zinc;hydrogen phosphate;phosphate?
The canonical SMILES for aluminum;zinc;hydrogen phosphate;phosphate is O=P([O-])([O-])O.O=P([O-])([O-])[O-].[Al+3].[Zn+2].
What is the InChIKey of aluminum;zinc;hydrogen phosphate;phosphate?
The InChIKey is LMOWHKIRCVHUHE-UHFFFAOYSA-I. The full InChI is InChI=1S/Al.2H3O4P.Zn/c;2*1-5(2,3)4;/h;2*(H3,1,2,3,4);/q+3;;;+2/p-5.
What are the key properties of aluminum;zinc;hydrogen phosphate;phosphate?
aluminum;zinc;hydrogen phosphate;phosphate has a molecular weight of 283.32 g/mol, XLogP of -5.40, 0 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for aluminum;zinc;hydrogen phosphate;phosphate is sourced from PubChem (CID 159394914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).