tripotassium;hexachlororuthenium(3-);hexahydrate

H12Cl6K3O6Ru — CID 175081398

IUPACtripotassium;hexachlororuthenium(3-);hexahydrate
SMILESCl[Ru-3](Cl)(Cl)(Cl)(Cl)Cl.O.O.O.O.O.O.[K+].[K+].[K+]
InChIInChI=1S/6ClH.3K.6H2O.Ru/h6*1H;;;;6*1H2;/q;;;;;;3*+1;;;;;;;+3/p-6
InChIKeyQLIIIBKKDUVBQU-UHFFFAOYSA-H
MW539.17 g/mol
LogP-9.80
Rot. Bonds

About tripotassium;hexachlororuthenium(3-);hexahydrate

tripotassium;hexachlororuthenium(3-);hexahydrate (PubChem CID 175081398) has the molecular formula H12Cl6K3O6Ru and a molecular weight of 539.17 g/mol. Its IUPAC name is tripotassium;hexachlororuthenium(3-);hexahydrate.

Molecular Properties

Compound Nametripotassium;hexachlororuthenium(3-);hexahydrate
PubChem CID175081398
Molecular FormulaH12Cl6K3O6Ru
Molecular Weight539.17 g/mol
Exact Mass536.67
IUPAC Nametripotassium;hexachlororuthenium(3-);hexahydrate
SMILESCl[Ru-3](Cl)(Cl)(Cl)(Cl)Cl.O.O.O.O.O.O.[K+].[K+].[K+]
InChIInChI=1S/6ClH.3K.6H2O.Ru/h6*1H;;;;6*1H2;/q;;;;;;3*+1;;;;;;;+3/p-6
InChIKeyQLIIIBKKDUVBQU-UHFFFAOYSA-H
XLogP-9.80
TPSA189.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500539.17
LogP ≤ 5-9.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of tripotassium;hexachlororuthenium(3-);hexahydrate?
The IUPAC name of tripotassium;hexachlororuthenium(3-);hexahydrate (CID 175081398) is tripotassium;hexachlororuthenium(3-);hexahydrate.
What is the SMILES notation for tripotassium;hexachlororuthenium(3-);hexahydrate?
The canonical SMILES for tripotassium;hexachlororuthenium(3-);hexahydrate is Cl[Ru-3](Cl)(Cl)(Cl)(Cl)Cl.O.O.O.O.O.O.[K+].[K+].[K+].
What is the InChIKey of tripotassium;hexachlororuthenium(3-);hexahydrate?
The InChIKey is QLIIIBKKDUVBQU-UHFFFAOYSA-H. The full InChI is InChI=1S/6ClH.3K.6H2O.Ru/h6*1H;;;;6*1H2;/q;;;;;;3*+1;;;;;;;+3/p-6.
What are the key properties of tripotassium;hexachlororuthenium(3-);hexahydrate?
tripotassium;hexachlororuthenium(3-);hexahydrate has a molecular weight of 539.17 g/mol, XLogP of -9.80, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tripotassium;hexachlororuthenium(3-);hexahydrate is sourced from PubChem (CID 175081398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).