hydron;iron(3+);phosphate

HFeO4P+ — CID 173036063

IUPAChydron;iron(3+);phosphate
SMILESO=P([O-])([O-])[O-].[Fe+3].[H+]
InChIInChI=1S/Fe.H3O4P/c;1-5(2,3)4/h;(H3,1,2,3,4)/q+3;/p-2
InChIKeyWBJZTOZJJYAKHQ-UHFFFAOYSA-L
MW151.82 g/mol
LogP-2.71
Rot. Bonds

About hydron;iron(3+);phosphate

hydron;iron(3+);phosphate (PubChem CID 173036063) has the molecular formula HFeO4P+ and a molecular weight of 151.82 g/mol. Its IUPAC name is hydron;iron(3+);phosphate.

Molecular Properties

Compound Namehydron;iron(3+);phosphate
PubChem CID173036063
Molecular FormulaHFeO4P+
Molecular Weight151.82 g/mol
Exact Mass151.90
IUPAC Namehydron;iron(3+);phosphate
SMILESO=P([O-])([O-])[O-].[Fe+3].[H+]
InChIInChI=1S/Fe.H3O4P/c;1-5(2,3)4/h;(H3,1,2,3,4)/q+3;/p-2
InChIKeyWBJZTOZJJYAKHQ-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 ≤ 500151.82
LogP ≤ 5-2.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

hydron;phosphate
CID 19972274
iron(3+);methane;phosphate
CID 88850558
hydron;zirconium;phosphate
CID 173215944
trilithium;iron(3+);diphosphate
CID 102600810
zinc;hydron;diphosphate
CID 20841752
azane;hydron;phosphate
CID 173322696
CID 158150177
CID 158150177
barium(2+);hydron;phosphate
CID 173013414
trimagnesium;iron(3+);triphosphate
CID 173343441
azane;hydron;titanium(4+);phosphate
CID 173494931
potassium;azane;hydron;phosphate
CID 173310600
dipotassium;trisodium;hydron;triphosphate
CID 173105953

Frequently Asked Questions

What is the IUPAC name of hydron;iron(3+);phosphate?
The IUPAC name of hydron;iron(3+);phosphate (CID 173036063) is hydron;iron(3+);phosphate.
What is the SMILES notation for hydron;iron(3+);phosphate?
The canonical SMILES for hydron;iron(3+);phosphate is O=P([O-])([O-])[O-].[Fe+3].[H+].
What is the InChIKey of hydron;iron(3+);phosphate?
The InChIKey is WBJZTOZJJYAKHQ-UHFFFAOYSA-L. The full InChI is InChI=1S/Fe.H3O4P/c;1-5(2,3)4/h;(H3,1,2,3,4)/q+3;/p-2.
What are the key properties of hydron;iron(3+);phosphate?
hydron;iron(3+);phosphate has a molecular weight of 151.82 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;iron(3+);phosphate is sourced from PubChem (CID 173036063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).