iron(2+);methanol

C2H6FeO2 — CID 87562713

IUPACiron(2+);methanol
SMILES[CH2-]O.[CH2-]O.[Fe+2]
InChIInChI=1S/2CH3O.Fe/c2*1-2;/h2*2H,1H2;/q2*-1;+2
InChIKeyMYZWIQPQTDDBON-UHFFFAOYSA-N
MW117.91 g/mol
LogP0.30
Rot. Bonds

About iron(2+);methanol

iron(2+);methanol (PubChem CID 87562713) has the molecular formula C2H6FeO2 and a molecular weight of 117.91 g/mol. Its IUPAC name is iron(2+);methanol.

Molecular Properties

Compound Nameiron(2+);methanol
PubChem CID87562713
Molecular FormulaC2H6FeO2
Molecular Weight117.91 g/mol
Exact Mass117.97
IUPAC Nameiron(2+);methanol
SMILES[CH2-]O.[CH2-]O.[Fe+2]
InChIInChI=1S/2CH3O.Fe/c2*1-2;/h2*2H,1H2;/q2*-1;+2
InChIKeyMYZWIQPQTDDBON-UHFFFAOYSA-N
XLogP0.30
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500117.91
LogP ≤ 50.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze iron(2+);methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

methanol;tris(rutherfordium)
CID 59398754
silver methanol
CID 71402078
methanol;nickel;hydrate
CID 172697123
carbanide;methanol;tungsten(2+)
CID 22951805
methanol;tungsten;yttrium
CID 59818412
ethane;methanol;vanadium(2+)
CID 21350446
bis(cyclopentane);methanol;zirconium(3+)
CID 23230165
chlorogold;methanol;tetrahydrate
CID 174525471
methane;methanol;methanol;titanium;pentahydrate
CID 158574676
dipotassium;carbonic acid;hydride;silanide
CID 173410681
hydrogen peroxide;iron(2+);dichloride
CID 173080852
potassium;azane;carbonic acid;ethane
CID 173108231

Frequently Asked Questions

What is the IUPAC name of iron(2+);methanol?
The IUPAC name of iron(2+);methanol (CID 87562713) is iron(2+);methanol.
What is the SMILES notation for iron(2+);methanol?
The canonical SMILES for iron(2+);methanol is [CH2-]O.[CH2-]O.[Fe+2].
What is the InChIKey of iron(2+);methanol?
The InChIKey is MYZWIQPQTDDBON-UHFFFAOYSA-N. The full InChI is InChI=1S/2CH3O.Fe/c2*1-2;/h2*2H,1H2;/q2*-1;+2.
What are the key properties of iron(2+);methanol?
iron(2+);methanol has a molecular weight of 117.91 g/mol, XLogP of 0.30, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for iron(2+);methanol is sourced from PubChem (CID 87562713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).