tetrazinc;zinc;dichloride;octahydroxide;hydrate

H10Cl2O9Zn5-2 — CID 165362686

IUPACtetrazinc;zinc;dichloride;octahydroxide;hydrate
SMILESO.[Cl-].[Cl-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[Zn+2].[Zn+2].[Zn+2].[Zn+2].[Zn]
InChIInChI=1S/2ClH.9H2O.5Zn/h2*1H;9*1H2;;;;;/q;;;;;;;;;;;;4*+2/p-10
InChIKeyHEVKFMXPAIKZQR-UHFFFAOYSA-D
MW551.93 g/mol
LogP-8.24
Rot. Bonds

About tetrazinc;zinc;dichloride;octahydroxide;hydrate

tetrazinc;zinc;dichloride;octahydroxide;hydrate (PubChem CID 165362686) has the molecular formula H10Cl2O9Zn5-2 and a molecular weight of 551.93 g/mol. Its IUPAC name is tetrazinc;zinc;dichloride;octahydroxide;hydrate.

Molecular Properties

Compound Nametetrazinc;zinc;dichloride;octahydroxide;hydrate
PubChem CID165362686
Molecular FormulaH10Cl2O9Zn5-2
Molecular Weight551.93 g/mol
Exact Mass543.62
IUPAC Nametetrazinc;zinc;dichloride;octahydroxide;hydrate
SMILESO.[Cl-].[Cl-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[Zn+2].[Zn+2].[Zn+2].[Zn+2].[Zn]
InChIInChI=1S/2ClH.9H2O.5Zn/h2*1H;9*1H2;;;;;/q;;;;;;;;;;;;4*+2/p-10
InChIKeyHEVKFMXPAIKZQR-UHFFFAOYSA-D
XLogP-8.24
TPSA271.50 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500551.93
LogP ≤ 5-8.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

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

Analyze tetrazinc;zinc;dichloride;octahydroxide;hydrate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of tetrazinc;zinc;dichloride;octahydroxide;hydrate?
The IUPAC name of tetrazinc;zinc;dichloride;octahydroxide;hydrate (CID 165362686) is tetrazinc;zinc;dichloride;octahydroxide;hydrate.
What is the SMILES notation for tetrazinc;zinc;dichloride;octahydroxide;hydrate?
The canonical SMILES for tetrazinc;zinc;dichloride;octahydroxide;hydrate is O.[Cl-].[Cl-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[OH-].[Zn+2].[Zn+2].[Zn+2].[Zn+2].[Zn].
What is the InChIKey of tetrazinc;zinc;dichloride;octahydroxide;hydrate?
The InChIKey is HEVKFMXPAIKZQR-UHFFFAOYSA-D. The full InChI is InChI=1S/2ClH.9H2O.5Zn/h2*1H;9*1H2;;;;;/q;;;;;;;;;;;;4*+2/p-10.
What are the key properties of tetrazinc;zinc;dichloride;octahydroxide;hydrate?
tetrazinc;zinc;dichloride;octahydroxide;hydrate has a molecular weight of 551.93 g/mol, XLogP of -8.24, 0 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for tetrazinc;zinc;dichloride;octahydroxide;hydrate is sourced from PubChem (CID 165362686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).