Zinc oxide

OZn — CID 14806

About Zinc oxide

Zinc oxide (PubChem CID 14806) has the molecular formula OZn and a molecular weight of 81.39 g/mol. Its IUPAC name is oxozinc.

Molecular Properties

• Compound Name: Zinc oxide
• PubChem CID: 14806
• Molecular Formula: OZn
• Molecular Weight: 81.39 g/mol
• Exact Mass: 79.92
• IUPAC Name: oxozinc
• SMILES: O=[Zn]
• InChI: InChI=1S/O.Zn
• InChIKey: XLOMVQKBTHCTTD-UHFFFAOYSA-N
• XLogP: -0.12
• TPSA: 17.07 Ų
• H-Bond Acceptors: 1
• Heavy Atoms: 2
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	81.39
LogP ≤ 5	-0.12
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	1

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of Zinc oxide?

The IUPAC name of Zinc oxide (CID 14806) is oxozinc.

What is the SMILES notation for Zinc oxide?

The canonical SMILES for Zinc oxide is O=[Zn].

What is the InChIKey of Zinc oxide?

The InChIKey is XLOMVQKBTHCTTD-UHFFFAOYSA-N. The full InChI is InChI=1S/O.Zn.

What are the key properties of Zinc oxide?

Zinc oxide has a molecular weight of 81.39 g/mol, XLogP of -0.12, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.

Where does this data come from?

All data for Zinc oxide is sourced from PubChem (CID 14806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 14806 — identifiers, structure, computed properties (public domain)
• DrugCentral drug card 4240 — approved-drug record (CC BY-SA 4.0)

How this page is built: methodology · editorial policy & corrections.