potassium;lanthanum(3+);tetranitrate

KLaN4O12 — CID 158686941

About potassium;lanthanum(3+);tetranitrate

potassium;lanthanum(3+);tetranitrate (PubChem CID 158686941) has the molecular formula KLaN4O12 and a molecular weight of 426.02 g/mol. Its IUPAC name is potassium;lanthanum(3+);tetranitrate.

Molecular Properties

• Compound Name: potassium;lanthanum(3+);tetranitrate
• PubChem CID: 158686941
• Molecular Formula: KLaN4O12
• Molecular Weight: 426.02 g/mol
• Exact Mass: 425.82
• IUPAC Name: potassium;lanthanum(3+);tetranitrate
• SMILES: O=[N+]([O-])[O-].O=[N+]([O-])[O-].O=[N+]([O-])[O-].O=[N+]([O-])[O-].[K+].[La+3]
• InChI: InChI=1S/K.La.4NO3/c;;4*2-1(3)4/q+1;+3;4*-1
• InChIKey: IFWANPFDGUGBOA-UHFFFAOYSA-N
• XLogP: -3.95
• TPSA: 264.80 Ų
• H-Bond Acceptors: 12
• Heavy Atoms: 18
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	426.02
LogP ≤ 5	-3.95
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	12

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of potassium;lanthanum(3+);tetranitrate?

The IUPAC name of potassium;lanthanum(3+);tetranitrate (CID 158686941) is potassium;lanthanum(3+);tetranitrate.

What is the SMILES notation for potassium;lanthanum(3+);tetranitrate?

The canonical SMILES for potassium;lanthanum(3+);tetranitrate is O=[N+]([O-])[O-].O=[N+]([O-])[O-].O=[N+]([O-])[O-].O=[N+]([O-])[O-].[K+].[La+3].

What is the InChIKey of potassium;lanthanum(3+);tetranitrate?

The InChIKey is IFWANPFDGUGBOA-UHFFFAOYSA-N. The full InChI is InChI=1S/K.La.4NO3/c;;4*2-1(3)4/q+1;+3;4*-1.

What are the key properties of potassium;lanthanum(3+);tetranitrate?

potassium;lanthanum(3+);tetranitrate has a molecular weight of 426.02 g/mol, XLogP of -3.95, 0 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.

Where does this data come from?

All data for potassium;lanthanum(3+);tetranitrate is sourced from PubChem (CID 158686941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).