formaldehyde;iron

C4H8FeO4 — CID 15325698

IUPACformaldehyde;iron
SMILESC=O.C=O.C=O.C=O.[Fe]
InChIInChI=1S/4CH2O.Fe/c4*1-2;/h4*1H2;
InChIKeyBKHVXXWYLIIERF-UHFFFAOYSA-N
MW175.95 g/mol
LogP-0.74
Rot. Bonds

About formaldehyde;iron

formaldehyde;iron (PubChem CID 15325698) has the molecular formula C4H8FeO4 and a molecular weight of 175.95 g/mol. Its IUPAC name is formaldehyde;iron.

Molecular Properties

Compound Nameformaldehyde;iron
PubChem CID15325698
Molecular FormulaC4H8FeO4
Molecular Weight175.95 g/mol
Exact Mass175.98
IUPAC Nameformaldehyde;iron
SMILESC=O.C=O.C=O.C=O.[Fe]
InChIInChI=1S/4CH2O.Fe/c4*1-2;/h4*1H2;
InChIKeyBKHVXXWYLIIERF-UHFFFAOYSA-N
XLogP-0.74
TPSA68.28 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms9
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.95
LogP ≤ 5-0.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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 formaldehyde;iron?
The IUPAC name of formaldehyde;iron (CID 15325698) is formaldehyde;iron.
What is the SMILES notation for formaldehyde;iron?
The canonical SMILES for formaldehyde;iron is C=O.C=O.C=O.C=O.[Fe].
What is the InChIKey of formaldehyde;iron?
The InChIKey is BKHVXXWYLIIERF-UHFFFAOYSA-N. The full InChI is InChI=1S/4CH2O.Fe/c4*1-2;/h4*1H2;.
What are the key properties of formaldehyde;iron?
formaldehyde;iron has a molecular weight of 175.95 g/mol, XLogP of -0.74, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for formaldehyde;iron is sourced from PubChem (CID 15325698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).