iron(3+);trifluoride;trihydrate

H6F3FeO3 — CID 44717421

IUPACiron(3+);trifluoride;trihydrate
SMILESO.O.O.[F-].[F-].[F-].[Fe+3]
InChIInChI=1S/3FH.Fe.3H2O/h3*1H;;3*1H2/q;;;+3;;;/p-3
InChIKeyXILAUHRDSUSGOG-UHFFFAOYSA-K
MW166.88 g/mol
LogP-11.46
Rot. Bonds

About iron(3+);trifluoride;trihydrate

iron(3+);trifluoride;trihydrate (PubChem CID 44717421) has the molecular formula H6F3FeO3 and a molecular weight of 166.88 g/mol. Its IUPAC name is iron(3+);trifluoride;trihydrate.

Molecular Properties

Compound Nameiron(3+);trifluoride;trihydrate
PubChem CID44717421
Molecular FormulaH6F3FeO3
Molecular Weight166.88 g/mol
Exact Mass166.96
IUPAC Nameiron(3+);trifluoride;trihydrate
SMILESO.O.O.[F-].[F-].[F-].[Fe+3]
InChIInChI=1S/3FH.Fe.3H2O/h3*1H;;3*1H2/q;;;+3;;;/p-3
InChIKeyXILAUHRDSUSGOG-UHFFFAOYSA-K
XLogP-11.46
TPSA94.50 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.88
LogP ≤ 5-11.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

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CID 159334620
cesium;fluoride;dihydrate
CID 175768231
sodium;iron(3+);tetrafluoride
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bis(iron(3+));trisulfide;hydrate
CID 172996049
chromium(3+);fluoride;hydrate
CID 18366492
manganese(2+);difluoride;hydrate
CID 158396525
azanium;iron(3+);trihydrate
CID 21475489
copper(1+);fluoride;hydrate
CID 174907699
lead(2+);difluoride;hydrate
CID 173398092
chromium(4+);pentafluoride;hydrate
CID 139031290
dipotassium;difluoride;hydrate
CID 160665899
hydron;iron(3+);dihydrate
CID 161394909

Frequently Asked Questions

What is the IUPAC name of iron(3+);trifluoride;trihydrate?
The IUPAC name of iron(3+);trifluoride;trihydrate (CID 44717421) is iron(3+);trifluoride;trihydrate.
What is the SMILES notation for iron(3+);trifluoride;trihydrate?
The canonical SMILES for iron(3+);trifluoride;trihydrate is O.O.O.[F-].[F-].[F-].[Fe+3].
What is the InChIKey of iron(3+);trifluoride;trihydrate?
The InChIKey is XILAUHRDSUSGOG-UHFFFAOYSA-K. The full InChI is InChI=1S/3FH.Fe.3H2O/h3*1H;;3*1H2/q;;;+3;;;/p-3.
What are the key properties of iron(3+);trifluoride;trihydrate?
iron(3+);trifluoride;trihydrate has a molecular weight of 166.88 g/mol, XLogP of -11.46, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for iron(3+);trifluoride;trihydrate is sourced from PubChem (CID 44717421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).