gadolinium(3+) ion triperchlorate

• ChemBase ID: 138465
• Molecular Formular: Cl3GdO12
• Molecular Mass: 455.6018
• Monoisotopic Mass: 454.76963648
• SMILES: [O-][Cl](=O)(=O)=O.[O-][Cl](=O)(=O)=O.[O-][Cl](=O)(=O)=O.[Gd+3]
• Canonical SMILES: [O-][Cl](=O)(=O)=O.[O-][Cl](=O)(=O)=O.[O-][Cl](=O)(=O)=O.[Gd+3]
• InChI: InChI=1S/3ClHO4.Gd/c3*2-1(3,4)5;/h3*(H,2,3,4,5);/q;;;+3/p-3
• InChIKey: HYBHAIGYQVICOT-UHFFFAOYSA-K

NAMES AND DATABASE IDS

Names

• IUPAC name: gadolinium(3+) ion triperchlorate
• IUPAC Traditional name: gadolinium(3+) ion triperchlorate
• Synonyms: Gadolinium(III) perchlorate solution; 高氯酸钆(III) 溶液

Database IDs

• CAS Number: 14017-52-8
• EC Number: 237-837-8
• PubChem SID: 162232721; 24868083
• PubChem CID: 15335704

CALCULATED PROPERTIES

• Acid pKa: -6.8919964
• H Acceptors: 4
• H Donor: 0
• LogD (pH = 5.5): -2.4740524
• LogD (pH = 7.4): -2.4740524
• Log P: -0.097653694
• Molar Refractivity: 11.9079 cm^3
• Polarizability: 5.355259 Å^3
• Polar Surface Area: 74.27 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Apperance: liquid
• Density: 1.445 g/mL at 25 °C
• Refractive Index: n20/D 1.442
• Vapor Pressure: 0.12 psi ( 20 °C); 1.68 psi ( 55 °C)

Safety Information

• European Hazard Symbols: Corrosive (C); Oxidising (O)
• UN Number: 3098
• Hazard Class: 5.1
• Packing Group: 2
• Risk Statements: 8-34
• Safety Statements: 17-26-27-36-36/37/39-45
• RID/ADR: UN 3098 5.1/PG 2

Product Information

• Concentration: 40 wt. % in H2O
• Linear Formula: Gd(ClO4)3