zinc;cobalt(2+);phosphonato phosphate

CoO7P2Zn — CID 159352499

IUPACzinc;cobalt(2+);phosphonato phosphate
SMILESO=P([O-])([O-])OP(=O)([O-])[O-].[Co+2].[Zn+2]
InChIInChI=1S/Co.H4O7P2.Zn/c;1-8(2,3)7-9(4,5)6;/h;(H2,1,2,3)(H2,4,5,6);/q+2;;+2/p-4
InChIKeyLHMSWLFKEKFJPT-UHFFFAOYSA-J
MW298.26 g/mol
LogP-3.34
Rot. Bonds2

About zinc;cobalt(2+);phosphonato phosphate

zinc;cobalt(2+);phosphonato phosphate (PubChem CID 159352499) has the molecular formula CoO7P2Zn and a molecular weight of 298.26 g/mol. Its IUPAC name is zinc;cobalt(2+);phosphonato phosphate.

Molecular Properties

Compound Namezinc;cobalt(2+);phosphonato phosphate
PubChem CID159352499
Molecular FormulaCoO7P2Zn
Molecular Weight298.26 g/mol
Exact Mass296.77
IUPAC Namezinc;cobalt(2+);phosphonato phosphate
SMILESO=P([O-])([O-])OP(=O)([O-])[O-].[Co+2].[Zn+2]
InChIInChI=1S/Co.H4O7P2.Zn/c;1-8(2,3)7-9(4,5)6;/h;(H2,1,2,3)(H2,4,5,6);/q+2;;+2/p-4
InChIKeyLHMSWLFKEKFJPT-UHFFFAOYSA-J
XLogP-3.34
TPSA135.61 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.26
LogP ≤ 5-3.34
H-Bond Donors ≤ 50
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

zinc;manganese(2+);phosphonato phosphate
CID 175473755
dizinc;phosphonato phosphate;dihydrate
CID 173452839
phosphonato phosphate
CID 644102
pentasodium;phosphonato phosphate;hydroxide
CID 158792062
tetrapotassium;tetrasodium;phosphonato phosphate
CID 19872331
tetrakis(cobalt(3+));phosphonato phosphate
CID 159266783
phosphonato phosphate;decahydrate
CID 22385493
phosphonato phosphate;bis(titanium(4+))
CID 158284224
pentasodium;phosphonato phosphate;fluoride
CID 23202687
heptasodium;tetrakis(iron(3+));phosphonato phosphate
CID 56846460
mercury;phosphonato phosphate
CID 157352193
sodium;chromium(3+);phosphonato phosphate
CID 159071425

Frequently Asked Questions

What is the IUPAC name of zinc;cobalt(2+);phosphonato phosphate?
The IUPAC name of zinc;cobalt(2+);phosphonato phosphate (CID 159352499) is zinc;cobalt(2+);phosphonato phosphate.
What is the SMILES notation for zinc;cobalt(2+);phosphonato phosphate?
The canonical SMILES for zinc;cobalt(2+);phosphonato phosphate is O=P([O-])([O-])OP(=O)([O-])[O-].[Co+2].[Zn+2].
What is the InChIKey of zinc;cobalt(2+);phosphonato phosphate?
The InChIKey is LHMSWLFKEKFJPT-UHFFFAOYSA-J. The full InChI is InChI=1S/Co.H4O7P2.Zn/c;1-8(2,3)7-9(4,5)6;/h;(H2,1,2,3)(H2,4,5,6);/q+2;;+2/p-4.
What are the key properties of zinc;cobalt(2+);phosphonato phosphate?
zinc;cobalt(2+);phosphonato phosphate has a molecular weight of 298.26 g/mol, XLogP of -3.34, 2 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for zinc;cobalt(2+);phosphonato phosphate is sourced from PubChem (CID 159352499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).