Disilver;bis(1-(pyridin-2-ylmethyl)benzotriazole);dinitrate

C₂₄H₂₀Ag₂N₁₀O₆ — CID 139069642

About Disilver;bis(1-(pyridin-2-ylmethyl)benzotriazole);dinitrate

Disilver;bis(1-(pyridin-2-ylmethyl)benzotriazole);dinitrate (PubChem CID 139069642) has the molecular formula C₂₄H₂₀Ag₂N₁₀O₆ and a molecular weight of 760.22 g/mol. Its IUPAC name is disilver;bis(1-(pyridin-2-ylmethyl)benzotriazole);dinitrate.

Molecular Properties

• Compound Name: Disilver;bis(1-(pyridin-2-ylmethyl)benzotriazole);dinitrate
• PubChem CID: 139069642
• Molecular Formula: C₂₄H₂₀Ag₂N₁₀O₆
• Molecular Weight: 760.22 g/mol
• Exact Mass: 757.97
• IUPAC Name: disilver;bis(1-(pyridin-2-ylmethyl)benzotriazole);dinitrate
• SMILES: O=[N+]([O-])[O-].O=[N+]([O-])[O-].[Ag+].[Ag+].c1ccc(Cn2nnc3ccccc32)nc1.c1ccc(Cn2nnc3ccccc32)nc1
• InChI: InChI=1S/2C12H10N4.2Ag.2NO3/c2*1-2-7-12-11(6-1)14-15-16(12)9-10-5-3-4-8-13-10;;;2*2-1(3)4/h2*1-8H,9H2;;;;/q;;2*+1;2*-1
• InChIKey: YOLJVNXUNBJBMS-UHFFFAOYSA-N
• XLogP: 3.27
• TPSA: 219.60 Ų
• H-Bond Acceptors: 14
• Rotatable Bonds: 4
• Heavy Atoms: 42
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	760.22
LogP ≤ 5	3.27
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	14

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 Disilver;bis(1-(pyridin-2-ylmethyl)benzotriazole);dinitrate?

The IUPAC name of Disilver;bis(1-(pyridin-2-ylmethyl)benzotriazole);dinitrate (CID 139069642) is disilver;bis(1-(pyridin-2-ylmethyl)benzotriazole);dinitrate.

What is the SMILES notation for Disilver;bis(1-(pyridin-2-ylmethyl)benzotriazole);dinitrate?

The canonical SMILES for Disilver;bis(1-(pyridin-2-ylmethyl)benzotriazole);dinitrate is O=[N+]([O-])[O-].O=[N+]([O-])[O-].[Ag+].[Ag+].c1ccc(Cn2nnc3ccccc32)nc1.c1ccc(Cn2nnc3ccccc32)nc1.

What is the InChIKey of Disilver;bis(1-(pyridin-2-ylmethyl)benzotriazole);dinitrate?

The InChIKey is YOLJVNXUNBJBMS-UHFFFAOYSA-N. The full InChI is InChI=1S/2C12H10N4.2Ag.2NO3/c2*1-2-7-12-11(6-1)14-15-16(12)9-10-5-3-4-8-13-10;;;2*2-1(3)4/h2*1-8H,9H2;;;;/q;;2*+1;2*-1.

What are the key properties of Disilver;bis(1-(pyridin-2-ylmethyl)benzotriazole);dinitrate?

Disilver;bis(1-(pyridin-2-ylmethyl)benzotriazole);dinitrate has a molecular weight of 760.22 g/mol, XLogP of 3.27, 4 rotatable bonds, 0 hydrogen bond donors, and 14 hydrogen bond acceptors.

Where does this data come from?

All data for Disilver;bis(1-(pyridin-2-ylmethyl)benzotriazole);dinitrate is sourced from PubChem (CID 139069642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 139069642 — identifiers, structure, computed properties (public domain)

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