zinc;hydron;diphosphate

H2O8P2Zn-2 — CID 20841752

IUPACzinc;hydron;diphosphate
SMILESO=P([O-])([O-])[O-].O=P([O-])([O-])[O-].[H+].[H+].[Zn+2]
InChIInChI=1S/2H3O4P.Zn/c2*1-5(2,3)4;/h2*(H3,1,2,3,4);/q;;+2/p-4
InChIKeyMFXMOUUKFMDYLM-UHFFFAOYSA-J
MW257.35 g/mol
LogP-5.43
Rot. Bonds

About zinc;hydron;diphosphate

zinc;hydron;diphosphate (PubChem CID 20841752) has the molecular formula H2O8P2Zn-2 and a molecular weight of 257.35 g/mol. Its IUPAC name is zinc;hydron;diphosphate.

Molecular Properties

Compound Namezinc;hydron;diphosphate
PubChem CID20841752
Molecular FormulaH2O8P2Zn-2
Molecular Weight257.35 g/mol
Exact Mass255.85
IUPAC Namezinc;hydron;diphosphate
SMILESO=P([O-])([O-])[O-].O=P([O-])([O-])[O-].[H+].[H+].[Zn+2]
InChIInChI=1S/2H3O4P.Zn/c2*1-5(2,3)4;/h2*(H3,1,2,3,4);/q;;+2/p-4
InChIKeyMFXMOUUKFMDYLM-UHFFFAOYSA-J
XLogP-5.43
TPSA172.50 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.35
LogP ≤ 5-5.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

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

Analyze zinc;hydron;diphosphate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

hydron;phosphate
CID 19972274
hydron;iron(3+);phosphate
CID 173036063
hydron;zirconium;phosphate
CID 173215944
zinc;indium(3+);phosphate
CID 159690150
zinc;niobium(5+);phosphate
CID 158075455
dizinc;vanadium;triphosphate
CID 173037971
azane;hydron;phosphate
CID 173322696
barium(2+);hydron;phosphate
CID 173013414
dipotassium;zinc;diphosphate
CID 11970412
azane;hydron;titanium(4+);phosphate
CID 173494931
silver;zinc;zirconium;phosphate
CID 175352769
potassium;azane;hydron;phosphate
CID 173310600

Frequently Asked Questions

What is the IUPAC name of zinc;hydron;diphosphate?
The IUPAC name of zinc;hydron;diphosphate (CID 20841752) is zinc;hydron;diphosphate.
What is the SMILES notation for zinc;hydron;diphosphate?
The canonical SMILES for zinc;hydron;diphosphate is O=P([O-])([O-])[O-].O=P([O-])([O-])[O-].[H+].[H+].[Zn+2].
What is the InChIKey of zinc;hydron;diphosphate?
The InChIKey is MFXMOUUKFMDYLM-UHFFFAOYSA-J. The full InChI is InChI=1S/2H3O4P.Zn/c2*1-5(2,3)4;/h2*(H3,1,2,3,4);/q;;+2/p-4.
What are the key properties of zinc;hydron;diphosphate?
zinc;hydron;diphosphate has a molecular weight of 257.35 g/mol, XLogP of -5.43, 0 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for zinc;hydron;diphosphate is sourced from PubChem (CID 20841752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).