oxidanium;zinc;diperchlorate;pentahydrate

H13Cl2O14Zn+ — CID 91654935

IUPACoxidanium;zinc;diperchlorate;pentahydrate
SMILESO.O.O.O.O.[O-][Cl+3]([O-])([O-])[O-].[O-][Cl+3]([O-])([O-])[O-].[OH3+].[Zn+2]
InChIInChI=1S/2ClHO4.6H2O.Zn/c2*2-1(3,4)5;;;;;;;/h2*(H,2,3,4,5);6*1H2;/q;;;;;;;;+2/p-1
InChIKeyPADPILQDYPIHQQ-UHFFFAOYSA-M
MW373.39 g/mol
LogP-14.56
Rot. Bonds

About oxidanium;zinc;diperchlorate;pentahydrate

oxidanium;zinc;diperchlorate;pentahydrate (PubChem CID 91654935) has the molecular formula H13Cl2O14Zn+ and a molecular weight of 373.39 g/mol. Its IUPAC name is oxidanium;zinc;diperchlorate;pentahydrate.

Molecular Properties

Compound Nameoxidanium;zinc;diperchlorate;pentahydrate
PubChem CID91654935
Molecular FormulaH13Cl2O14Zn+
Molecular Weight373.39 g/mol
Exact Mass370.90
IUPAC Nameoxidanium;zinc;diperchlorate;pentahydrate
SMILESO.O.O.O.O.[O-][Cl+3]([O-])([O-])[O-].[O-][Cl+3]([O-])([O-])[O-].[OH3+].[Zn+2]
InChIInChI=1S/2ClHO4.6H2O.Zn/c2*2-1(3,4)5;;;;;;;/h2*(H,2,3,4,5);6*1H2;/q;;;;;;;;+2/p-1
InChIKeyPADPILQDYPIHQQ-UHFFFAOYSA-M
XLogP-14.56
TPSA374.98 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.39
LogP ≤ 5-14.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of oxidanium;zinc;diperchlorate;pentahydrate?
The IUPAC name of oxidanium;zinc;diperchlorate;pentahydrate (CID 91654935) is oxidanium;zinc;diperchlorate;pentahydrate.
What is the SMILES notation for oxidanium;zinc;diperchlorate;pentahydrate?
The canonical SMILES for oxidanium;zinc;diperchlorate;pentahydrate is O.O.O.O.O.[O-][Cl+3]([O-])([O-])[O-].[O-][Cl+3]([O-])([O-])[O-].[OH3+].[Zn+2].
What is the InChIKey of oxidanium;zinc;diperchlorate;pentahydrate?
The InChIKey is PADPILQDYPIHQQ-UHFFFAOYSA-M. The full InChI is InChI=1S/2ClHO4.6H2O.Zn/c2*2-1(3,4)5;;;;;;;/h2*(H,2,3,4,5);6*1H2;/q;;;;;;;;+2/p-1.
What are the key properties of oxidanium;zinc;diperchlorate;pentahydrate?
oxidanium;zinc;diperchlorate;pentahydrate has a molecular weight of 373.39 g/mol, XLogP of -14.56, 0 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for oxidanium;zinc;diperchlorate;pentahydrate is sourced from PubChem (CID 91654935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).