iron;hydrochloride

HClFe — CID 86633186

IUPACiron;hydrochloride
SMILESCl.[Fe]
InChIInChI=1S/ClH.Fe/h1H;
InChIKeyFBAFATDZDUQKNH-UHFFFAOYSA-N
MW92.31 g/mol
LogP0.42
Rot. Bonds

About iron;hydrochloride

iron;hydrochloride (PubChem CID 86633186) has the molecular formula HClFe and a molecular weight of 92.31 g/mol. Its IUPAC name is iron;hydrochloride.

Molecular Properties

Compound Nameiron;hydrochloride
PubChem CID86633186
Molecular FormulaHClFe
Molecular Weight92.31 g/mol
Exact Mass91.91
IUPAC Nameiron;hydrochloride
SMILESCl.[Fe]
InChIInChI=1S/ClH.Fe/h1H;
InChIKeyFBAFATDZDUQKNH-UHFFFAOYSA-N
XLogP0.42
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms2
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50092.31
LogP ≤ 50.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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 iron;hydrochloride?
The IUPAC name of iron;hydrochloride (CID 86633186) is iron;hydrochloride.
What is the SMILES notation for iron;hydrochloride?
The canonical SMILES for iron;hydrochloride is Cl.[Fe].
What is the InChIKey of iron;hydrochloride?
The InChIKey is FBAFATDZDUQKNH-UHFFFAOYSA-N. The full InChI is InChI=1S/ClH.Fe/h1H;.
What are the key properties of iron;hydrochloride?
iron;hydrochloride has a molecular weight of 92.31 g/mol, XLogP of 0.42, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for iron;hydrochloride is sourced from PubChem (CID 86633186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).