copper;zinc;cadmium(2+);diphosphate

CdCuO8P2Zn — CID 159305058

IUPACcopper;zinc;cadmium(2+);diphosphate
SMILESO=P([O-])([O-])[O-].O=P([O-])([O-])[O-].[Cd+2].[Cu+2].[Zn+2]
InChIInChI=1S/Cd.Cu.2H3O4P.Zn/c;;2*1-5(2,3)4;/h;;2*(H3,1,2,3,4);/q2*+2;;;+2/p-6
InChIKeyLBUUWPHMZIJFSO-UHFFFAOYSA-H
MW431.29 g/mol
LogP-5.66
Rot. Bonds

About copper;zinc;cadmium(2+);diphosphate

copper;zinc;cadmium(2+);diphosphate (PubChem CID 159305058) has the molecular formula CdCuO8P2Zn and a molecular weight of 431.29 g/mol. Its IUPAC name is copper;zinc;cadmium(2+);diphosphate.

Molecular Properties

Compound Namecopper;zinc;cadmium(2+);diphosphate
PubChem CID159305058
Molecular FormulaCdCuO8P2Zn
Molecular Weight431.29 g/mol
Exact Mass430.67
IUPAC Namecopper;zinc;cadmium(2+);diphosphate
SMILESO=P([O-])([O-])[O-].O=P([O-])([O-])[O-].[Cd+2].[Cu+2].[Zn+2]
InChIInChI=1S/Cd.Cu.2H3O4P.Zn/c;;2*1-5(2,3)4;/h;;2*(H3,1,2,3,4);/q2*+2;;;+2/p-6
InChIKeyLBUUWPHMZIJFSO-UHFFFAOYSA-H
XLogP-5.66
TPSA172.50 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500431.29
LogP ≤ 5-5.66
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'}

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Related Compounds

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CID 20841752
pentacopper;bis(oxygen(2-));diphosphate
CID 173096360
dipotassium;zinc;diphosphate
CID 11970412
silver;zinc;zirconium;phosphate
CID 175352769
copper;sodium;zirconium;phosphate
CID 175582678
zirconium(4+) phosphate
CID 21124562
bis(gadolinium(3+)) diphosphate
CID 172754975
trialuminum;triphosphate
CID 23371115
dipotassium diphosphate
CID 18612384

Frequently Asked Questions

What is the IUPAC name of copper;zinc;cadmium(2+);diphosphate?
The IUPAC name of copper;zinc;cadmium(2+);diphosphate (CID 159305058) is copper;zinc;cadmium(2+);diphosphate.
What is the SMILES notation for copper;zinc;cadmium(2+);diphosphate?
The canonical SMILES for copper;zinc;cadmium(2+);diphosphate is O=P([O-])([O-])[O-].O=P([O-])([O-])[O-].[Cd+2].[Cu+2].[Zn+2].
What is the InChIKey of copper;zinc;cadmium(2+);diphosphate?
The InChIKey is LBUUWPHMZIJFSO-UHFFFAOYSA-H. The full InChI is InChI=1S/Cd.Cu.2H3O4P.Zn/c;;2*1-5(2,3)4;/h;;2*(H3,1,2,3,4);/q2*+2;;;+2/p-6.
What are the key properties of copper;zinc;cadmium(2+);diphosphate?
copper;zinc;cadmium(2+);diphosphate has a molecular weight of 431.29 g/mol, XLogP of -5.66, 0 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for copper;zinc;cadmium(2+);diphosphate is sourced from PubChem (CID 159305058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).