iron(4+);chloride;phosphate

ClFeO4P — CID 174456268

IUPACiron(4+);chloride;phosphate
SMILESO=P([O-])([O-])[O-].[Cl-].[Fe+4]
InChIInChI=1S/ClH.Fe.H3O4P/c;;1-5(2,3)4/h1H;;(H3,1,2,3,4)/q;+4;/p-4
InChIKeyTYRHHMXAYCOWPZ-UHFFFAOYSA-J
MW186.27 g/mol
LogP-5.82
Rot. Bonds

About iron(4+);chloride;phosphate

iron(4+);chloride;phosphate (PubChem CID 174456268) has the molecular formula ClFeO4P and a molecular weight of 186.27 g/mol. Its IUPAC name is iron(4+);chloride;phosphate.

Molecular Properties

Compound Nameiron(4+);chloride;phosphate
PubChem CID174456268
Molecular FormulaClFeO4P
Molecular Weight186.27 g/mol
Exact Mass185.86
IUPAC Nameiron(4+);chloride;phosphate
SMILESO=P([O-])([O-])[O-].[Cl-].[Fe+4]
InChIInChI=1S/ClH.Fe.H3O4P/c;;1-5(2,3)4/h1H;;(H3,1,2,3,4)/q;+4;/p-4
InChIKeyTYRHHMXAYCOWPZ-UHFFFAOYSA-J
XLogP-5.82
TPSA86.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.27
LogP ≤ 5-5.82
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

bis(palladium(2+));chloride;phosphate
CID 173092002
iron(4+);hydroxide;phosphate;hydrate
CID 173185954
magnesium;disodium;chloride;phosphate
CID 21257942
octadecaazanium;hexaphosphate
CID 158249396
tris(thorium(4+));tetraphosphate
CID 21475626
molybdenum diphosphate
CID 22395595
methane phosphate
CID 22352647
CID 23618823
CID 23618823
CID 23618830
CID 23618830
sodium phosphate
CID 21225609
hydron;phosphate
CID 19972274
dipotassium diphosphate
CID 18612384

Frequently Asked Questions

What is the IUPAC name of iron(4+);chloride;phosphate?
The IUPAC name of iron(4+);chloride;phosphate (CID 174456268) is iron(4+);chloride;phosphate.
What is the SMILES notation for iron(4+);chloride;phosphate?
The canonical SMILES for iron(4+);chloride;phosphate is O=P([O-])([O-])[O-].[Cl-].[Fe+4].
What is the InChIKey of iron(4+);chloride;phosphate?
The InChIKey is TYRHHMXAYCOWPZ-UHFFFAOYSA-J. The full InChI is InChI=1S/ClH.Fe.H3O4P/c;;1-5(2,3)4/h1H;;(H3,1,2,3,4)/q;+4;/p-4.
What are the key properties of iron(4+);chloride;phosphate?
iron(4+);chloride;phosphate has a molecular weight of 186.27 g/mol, XLogP of -5.82, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for iron(4+);chloride;phosphate is sourced from PubChem (CID 174456268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).