sodium;iron;chloride

ClFeNa — CID 173054811

IUPACsodium;iron;chloride
SMILES[Cl-].[Fe].[Na+]
InChIInChI=1S/ClH.Fe.Na/h1H;;/q;;+1/p-1
InChIKeyGVQGQWBYJGHCKM-UHFFFAOYSA-M
MW114.29 g/mol
LogP-5.99
Rot. Bonds

About sodium;iron;chloride

sodium;iron;chloride (PubChem CID 173054811) has the molecular formula ClFeNa and a molecular weight of 114.29 g/mol. Its IUPAC name is sodium;iron;chloride.

Molecular Properties

Compound Namesodium;iron;chloride
PubChem CID173054811
Molecular FormulaClFeNa
Molecular Weight114.29 g/mol
Exact Mass113.89
IUPAC Namesodium;iron;chloride
SMILES[Cl-].[Fe].[Na+]
InChIInChI=1S/ClH.Fe.Na/h1H;;/q;;+1/p-1
InChIKeyGVQGQWBYJGHCKM-UHFFFAOYSA-M
XLogP-5.99
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms3
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500114.29
LogP ≤ 5-5.99
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 sodium;iron;chloride?
The IUPAC name of sodium;iron;chloride (CID 173054811) is sodium;iron;chloride.
What is the SMILES notation for sodium;iron;chloride?
The canonical SMILES for sodium;iron;chloride is [Cl-].[Fe].[Na+].
What is the InChIKey of sodium;iron;chloride?
The InChIKey is GVQGQWBYJGHCKM-UHFFFAOYSA-M. The full InChI is InChI=1S/ClH.Fe.Na/h1H;;/q;;+1/p-1.
What are the key properties of sodium;iron;chloride?
sodium;iron;chloride has a molecular weight of 114.29 g/mol, XLogP of -5.99, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;iron;chloride is sourced from PubChem (CID 173054811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).