azane;iron(2+);oxygen(2-);dihydrate

H7FeNO3 — CID 172756089

IUPACazane;iron(2+);oxygen(2-);dihydrate
SMILESN.O.O.[Fe+2].[O-2]
InChIInChI=1S/Fe.H3N.2H2O.O/h;1H3;2*1H2;/q+2;;;;-2
InChIKeyLASGBIXRFSYLIP-UHFFFAOYSA-N
MW124.91 g/mol
LogP-1.61
Rot. Bonds

About azane;iron(2+);oxygen(2-);dihydrate

azane;iron(2+);oxygen(2-);dihydrate (PubChem CID 172756089) has the molecular formula H7FeNO3 and a molecular weight of 124.91 g/mol. Its IUPAC name is azane;iron(2+);oxygen(2-);dihydrate.

Molecular Properties

Compound Nameazane;iron(2+);oxygen(2-);dihydrate
PubChem CID172756089
Molecular FormulaH7FeNO3
Molecular Weight124.91 g/mol
Exact Mass124.98
IUPAC Nameazane;iron(2+);oxygen(2-);dihydrate
SMILESN.O.O.[Fe+2].[O-2]
InChIInChI=1S/Fe.H3N.2H2O.O/h;1H3;2*1H2;/q+2;;;;-2
InChIKeyLASGBIXRFSYLIP-UHFFFAOYSA-N
XLogP-1.61
TPSA126.50 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.91
LogP ≤ 5-1.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of azane;iron(2+);oxygen(2-);dihydrate?
The IUPAC name of azane;iron(2+);oxygen(2-);dihydrate (CID 172756089) is azane;iron(2+);oxygen(2-);dihydrate.
What is the SMILES notation for azane;iron(2+);oxygen(2-);dihydrate?
The canonical SMILES for azane;iron(2+);oxygen(2-);dihydrate is N.O.O.[Fe+2].[O-2].
What is the InChIKey of azane;iron(2+);oxygen(2-);dihydrate?
The InChIKey is LASGBIXRFSYLIP-UHFFFAOYSA-N. The full InChI is InChI=1S/Fe.H3N.2H2O.O/h;1H3;2*1H2;/q+2;;;;-2.
What are the key properties of azane;iron(2+);oxygen(2-);dihydrate?
azane;iron(2+);oxygen(2-);dihydrate has a molecular weight of 124.91 g/mol, XLogP of -1.61, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for azane;iron(2+);oxygen(2-);dihydrate is sourced from PubChem (CID 172756089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).