iron(3+);heptahydrate

H14FeO7+3 — CID 159334620

IUPACiron(3+);heptahydrate
SMILESO.O.O.O.O.O.O.[Fe+3]
InChIInChI=1S/Fe.7H2O/h;7*1H2/q+3;;;;;;;
InChIKeyLFJIFWVCMYUAHY-UHFFFAOYSA-N
MW181.95 g/mol
LogP-5.78
Rot. Bonds

About iron(3+);heptahydrate

iron(3+);heptahydrate (PubChem CID 159334620) has the molecular formula H14FeO7+3 and a molecular weight of 181.95 g/mol. Its IUPAC name is iron(3+);heptahydrate.

Molecular Properties

Compound Nameiron(3+);heptahydrate
PubChem CID159334620
Molecular FormulaH14FeO7+3
Molecular Weight181.95 g/mol
Exact Mass182.01
IUPAC Nameiron(3+);heptahydrate
SMILESO.O.O.O.O.O.O.[Fe+3]
InChIInChI=1S/Fe.7H2O/h;7*1H2/q+3;;;;;;;
InChIKeyLFJIFWVCMYUAHY-UHFFFAOYSA-N
XLogP-5.78
TPSA220.50 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.95
LogP ≤ 5-5.78
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

bis(iron(3+));trisulfide;hydrate
CID 172996049
azanium;iron(3+);trihydrate
CID 21475489
hydron;iron(3+);dihydrate
CID 161394909
iron(3+);trifluoride;trihydrate
CID 44717421
oxidane
CID 173081003
chromium;bis(iron(3+));hexahydroxide;hexahydrate
CID 170839029
oxidane
CID 657017
iron(3+);oxygen(2-);hydroxide;hydrate
CID 23320441
tribromoscandium;tetrahydrate
CID 175768333
trichloroscandium;hexahydrate
CID 71311389
iron;trihydrate
CID 173070166
titanium;octadecahydrate
CID 173222579

Frequently Asked Questions

What is the IUPAC name of iron(3+);heptahydrate?
The IUPAC name of iron(3+);heptahydrate (CID 159334620) is iron(3+);heptahydrate.
What is the SMILES notation for iron(3+);heptahydrate?
The canonical SMILES for iron(3+);heptahydrate is O.O.O.O.O.O.O.[Fe+3].
What is the InChIKey of iron(3+);heptahydrate?
The InChIKey is LFJIFWVCMYUAHY-UHFFFAOYSA-N. The full InChI is InChI=1S/Fe.7H2O/h;7*1H2/q+3;;;;;;;.
What are the key properties of iron(3+);heptahydrate?
iron(3+);heptahydrate has a molecular weight of 181.95 g/mol, XLogP of -5.78, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for iron(3+);heptahydrate is sourced from PubChem (CID 159334620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).