CID 173462634

HHgInNaTl — CID 173462634

IUPAC—
SMILES[H-].[Hg].[In].[Na+].[Tl]
InChIInChI=1S/Hg.In.Na.Tl.H/q;;+1;;-1
InChIKeyQRLKNGDTGVZPKH-UHFFFAOYSA-N
MW543.79 g/mol
LogP-3.65
Rot. Bonds

About CID 173462634

CID 173462634 (PubChem CID 173462634) has the molecular formula HHgInNaTl and a molecular weight of 543.79 g/mol.

Molecular Properties

Compound NameCID 173462634
PubChem CID173462634
Molecular FormulaHHgInNaTl
Molecular Weight543.79 g/mol
Exact Mass545.85
IUPAC Name—
SMILES[H-].[Hg].[In].[Na+].[Tl]
InChIInChI=1S/Hg.In.Na.Tl.H/q;;+1;;-1
InChIKeyQRLKNGDTGVZPKH-UHFFFAOYSA-N
XLogP-3.65
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms4
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500543.79
LogP ≤ 5-3.65
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 CID 173462634?
The IUPAC name of CID 173462634 (CID 173462634) is not available.
What is the SMILES notation for CID 173462634?
The canonical SMILES for CID 173462634 is [H-].[Hg].[In].[Na+].[Tl].
What is the InChIKey of CID 173462634?
The InChIKey is QRLKNGDTGVZPKH-UHFFFAOYSA-N. The full InChI is InChI=1S/Hg.In.Na.Tl.H/q;;+1;;-1.
What are the key properties of CID 173462634?
CID 173462634 has a molecular weight of 543.79 g/mol, XLogP of -3.65, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 173462634 is sourced from PubChem (CID 173462634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).