Dicalcium diiodide

Ca₂I₂+2 — CID 158569539

About Dicalcium diiodide

Dicalcium diiodide (PubChem CID 158569539) has the molecular formula Ca₂I₂+2 and a molecular weight of 333.96 g/mol. Its IUPAC name is dicalcium diiodide.

Molecular Properties

• Compound Name: Dicalcium diiodide
• PubChem CID: 158569539
• Molecular Formula: Ca₂I₂+2
• Molecular Weight: 333.96 g/mol
• Exact Mass: 333.73
• IUPAC Name: dicalcium diiodide
• SMILES: [Ca+2].[Ca+2].[I-].[I-]
• InChI: InChI=1S/2Ca.2HI/h;;2*1H/q2*+2;;/p-2
• InChIKey: HRXHIAYZXZTXCW-UHFFFAOYSA-L
• XLogP: -6.75
• TPSA: 0.00 Ų
• Heavy Atoms: 4
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	333.96
LogP ≤ 5	-6.75
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	0

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of Dicalcium diiodide?

The IUPAC name of Dicalcium diiodide (CID 158569539) is dicalcium diiodide.

What is the SMILES notation for Dicalcium diiodide?

The canonical SMILES for Dicalcium diiodide is [Ca+2].[Ca+2].[I-].[I-].

What is the InChIKey of Dicalcium diiodide?

The InChIKey is HRXHIAYZXZTXCW-UHFFFAOYSA-L. The full InChI is InChI=1S/2Ca.2HI/h;;2*1H/q2*+2;;/p-2.

What are the key properties of Dicalcium diiodide?

Dicalcium diiodide has a molecular weight of 333.96 g/mol, XLogP of -6.75, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.

Where does this data come from?

All data for Dicalcium diiodide is sourced from PubChem (CID 158569539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 158569539 — identifiers, structure, computed properties (public domain)

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