hydron;zirconium;phosphate

HO4PZr-2 — CID 173215944

IUPAChydron;zirconium;phosphate
SMILESO=P([O-])([O-])[O-].[H+].[Zr]
InChIInChI=1S/H3O4P.Zr/c1-5(2,3)4;/h(H3,1,2,3,4);/p-2
InChIKeySDKTUKJXHDZWMB-UHFFFAOYSA-L
MW187.20 g/mol
LogP-2.71
Rot. Bonds

About hydron;zirconium;phosphate

hydron;zirconium;phosphate (PubChem CID 173215944) has the molecular formula HO4PZr-2 and a molecular weight of 187.20 g/mol. Its IUPAC name is hydron;zirconium;phosphate.

Molecular Properties

Compound Namehydron;zirconium;phosphate
PubChem CID173215944
Molecular FormulaHO4PZr-2
Molecular Weight187.20 g/mol
Exact Mass185.87
IUPAC Namehydron;zirconium;phosphate
SMILESO=P([O-])([O-])[O-].[H+].[Zr]
InChIInChI=1S/H3O4P.Zr/c1-5(2,3)4;/h(H3,1,2,3,4);/p-2
InChIKeySDKTUKJXHDZWMB-UHFFFAOYSA-L
XLogP-2.71
TPSA86.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.20
LogP ≤ 5-2.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

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CID 173448097
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CID 175582678
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CID 173105953
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CID 175352769
azane;hydron;titanium(4+);phosphate
CID 173494931

Frequently Asked Questions

What is the IUPAC name of hydron;zirconium;phosphate?
The IUPAC name of hydron;zirconium;phosphate (CID 173215944) is hydron;zirconium;phosphate.
What is the SMILES notation for hydron;zirconium;phosphate?
The canonical SMILES for hydron;zirconium;phosphate is O=P([O-])([O-])[O-].[H+].[Zr].
What is the InChIKey of hydron;zirconium;phosphate?
The InChIKey is SDKTUKJXHDZWMB-UHFFFAOYSA-L. The full InChI is InChI=1S/H3O4P.Zr/c1-5(2,3)4;/h(H3,1,2,3,4);/p-2.
What are the key properties of hydron;zirconium;phosphate?
hydron;zirconium;phosphate has a molecular weight of 187.20 g/mol, XLogP of -2.71, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for hydron;zirconium;phosphate is sourced from PubChem (CID 173215944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).