gadolinium(3+) ion tribromide

• ChemBase ID: 302962
• Molecular Formular: Br3Gd
• Molecular Mass: 396.962
• Monoisotopic Mass: 394.679114
• SMILES: [Br-].[Br-].[Br-].[Gd+3]
• Canonical SMILES: [Br-].[Br-].[Br-].[Gd+3]
• InChI: InChI=1S/3BrH.Gd/h3*1H;/q;;;+3/p-3
• InChIKey: KGOKDPWKDBWITQ-UHFFFAOYSA-K

NAMES AND DATABASE IDS

Names

• IUPAC name: gadolinium(3+) ion tribromide
• IUPAC Traditional name: gadolinium(3+) ion tribromide
• Synonyms: Gadolinium(III) bromide, ultra dry; Gadolinium(III) bromide hydrate, REacton®; 溴化钆(III), 超干; 溴化钆(III),超干; 溴化钆(III)水合物, REacton®

Database IDs

• CAS Number: 13818-75-2; 30010-20-9
• EC Number: 237-494-4
• MDL Number: MFCD00049741

CALCULATED PROPERTIES

• Acid pKa: -8.0
• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 1.0182534
• LogD (pH = 7.4): 1.0182534
• Log P: 0.797834
• Molar Refractivity: 8.5991 cm^3
• Polarizability: 3.2406807 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Apperance: Crystalline; Powder, Ampouled under argon
• Melting Point: 186°C; 770°C

Safety Information

• Storage Warning: Hygroscopic
• European Hazard Symbols: Irritant (Xi)
• Risk Statements: 36/37/38
• Safety Statements: 26; 26-37
• TSCA Listed: 是
• GHS Pictograms: GHS07
• GHS Hazard statements: H315-H319-H335
• GHS Precautionary statements: P261-P305+P351+P338-P302+P352-P321-P405-P501A

Product Information

• Purity: 99.9% (REO); 99.99% (metals basis); 99.99% (REO)