CID 173419117

Br6K6O18Te6 — CID 173419117

IUPAC—
SMILESO=[Te](=O)([O-])Br.O=[Te](=O)([O-])Br.O=[Te](=O)([O-])Br.O=[Te](=O)([O-])Br.O=[Te](=O)([O-])Br.O=[Te](=O)([O-])Br.[K+].[K+].[K+].[K+].[K+].[K+]
InChIInChI=1S/6BrHO3Te.6K/c6*1-5(2,3)4;;;;;;/h6*(H,2,3,4);;;;;;/q;;;;;;6*+1/p-6
InChIKeyVQKPGPIORQWEEH-UHFFFAOYSA-H
MW1767.59 g/mol
LogP-23.75
Rot. Bonds

About CID 173419117

CID 173419117 (PubChem CID 173419117) has the molecular formula Br6K6O18Te6 and a molecular weight of 1767.59 g/mol.

Molecular Properties

Compound NameCID 173419117
PubChem CID173419117
Molecular FormulaBr6K6O18Te6
Molecular Weight1767.59 g/mol
Exact Mass1774.64
IUPAC Name—
SMILESO=[Te](=O)([O-])Br.O=[Te](=O)([O-])Br.O=[Te](=O)([O-])Br.O=[Te](=O)([O-])Br.O=[Te](=O)([O-])Br.O=[Te](=O)([O-])Br.[K+].[K+].[K+].[K+].[K+].[K+]
InChIInChI=1S/6BrHO3Te.6K/c6*1-5(2,3)4;;;;;;/h6*(H,2,3,4);;;;;;/q;;;;;;6*+1/p-6
InChIKeyVQKPGPIORQWEEH-UHFFFAOYSA-H
XLogP-23.75
TPSA343.20 Ų
H-Bond Donors
H-Bond Acceptors18
Rotatable Bonds
Heavy Atoms36
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001767.59
LogP ≤ 5-23.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1018

Computed Properties (RDKit)

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

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of CID 173419117?
The IUPAC name of CID 173419117 (CID 173419117) is not available.
What is the SMILES notation for CID 173419117?
The canonical SMILES for CID 173419117 is O=[Te](=O)([O-])Br.O=[Te](=O)([O-])Br.O=[Te](=O)([O-])Br.O=[Te](=O)([O-])Br.O=[Te](=O)([O-])Br.O=[Te](=O)([O-])Br.[K+].[K+].[K+].[K+].[K+].[K+].
What is the InChIKey of CID 173419117?
The InChIKey is VQKPGPIORQWEEH-UHFFFAOYSA-H. The full InChI is InChI=1S/6BrHO3Te.6K/c6*1-5(2,3)4;;;;;;/h6*(H,2,3,4);;;;;;/q;;;;;;6*+1/p-6.
What are the key properties of CID 173419117?
CID 173419117 has a molecular weight of 1767.59 g/mol, XLogP of -23.75, 0 rotatable bonds, 0 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for CID 173419117 is sourced from PubChem (CID 173419117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).