palladium(2+) ion hydrate di(potassiosulfanyl)sulfonate

• ChemBase ID: 138271
• Molecular Formular: H2K2O7PdS4
• Molecular Mass: 426.88828
• Monoisotopic Mass: 425.69923576
• SMILES: O.[O-]S(=O)(=O)S[K].[O-]S(=O)(=O)S[K].[Pd+2]
• Canonical SMILES: [K]SS(=O)(=O)[O-].[K]SS(=O)(=O)[O-].O.[Pd+2]
• InChI: InChI=1S/2K.2H2O3S2.H2O.Pd/c;;2*1-5(2,3)4;;/h;;2*(H2,1,2,3,4);1H2;/q2*+1;;;;+2/p-4
• InChIKey: QOHRLWWRKPUXTK-UHFFFAOYSA-J

NAMES AND DATABASE IDS

Names

• IUPAC name: palladium(2+) ion hydrate di(potassiosulfanyl)sulfonate
• IUPAC Traditional name: palladium(2+) ion hydrate dipotassiosulfanylsulfonate
• Synonyms: Palladium(II) potassium thiosulfate monohydrate; 硫代硫酸钯(II)钾 一水合物

Database IDs

• CAS Number: 312624-02-5
• MDL Number: MFCD01863569
• PubChem SID: 24872942; 162232528
• PubChem CID: 71310127

CALCULATED PROPERTIES

• Acid pKa: -2.2969494
• H Acceptors: 3
• H Donor: 0
• LogD (pH = 5.5): -4.0165987
• LogD (pH = 7.4): -4.0166
• Log P: -1.7528
• Molar Refractivity: 15.8403 cm^3
• Polarizability: 10.884601 Å^3
• Polar Surface Area: 57.2 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Apperance: powder
• Melting Point: 172 °C (dec.)(lit.)

Safety Information

• European Hazard Symbols: Irritant (Xi)
• German water hazard class: 3
• Risk Statements: 36/37/38
• Safety Statements: 26-36

Product Information

• Purity: 97%
• Linear Formula: K2Pd(S2O3)2·H2O