samarium(3+) ion hexahydrate tribromide

• ChemBase ID: 295482
• Molecular Formular: Br3O6Sm
• Molecular Mass: 486.0684
• Monoisotopic Mass: 484.64423072
• SMILES: O.O.O.O.O.O.[Br-].[Br-].[Br-].[Sm+3]
• Canonical SMILES: O.O.O.O.O.O.[Br-].[Br-].[Br-].[Sm+3]
• InChI: InChI=1S/3BrH.6H2O.Sm/h3*1H;6*1H2;/q;;;;;;;;;+3/p-3
• InChIKey: LXJDCZVUWJNXRL-UHFFFAOYSA-K

NAMES AND DATABASE IDS

Names

• IUPAC name: samarium(3+) ion hexahydrate tribromide
• IUPAC Traditional name: samarium(3+) ion hexahydrate tribromide
• Synonyms: Samarium(III) bromide hexahydrate; Samarium(III) bromide hexahydrate, REacton®; 六水溴化钐(III); 六水溴化钐, REacton®

Database IDs

• CAS Number: 13517-12-9
• EC Number: 237-347-4
• MDL Number: MFCD00192430
• PubChem SID: 180681013
• PubChem CID: 57348178

CALCULATED PROPERTIES

• Acid pKa: 15.7
• H Acceptors: 1
• H Donor: 1
• LogD (pH = 5.5): -0.652
• LogD (pH = 7.4): -0.652
• Log P: -0.652
• Molar Refractivity: 3.7 cm^3
• Polarizability: 1.4714895 Å^3
• Polar Surface Area: 25.3 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Apperance: Crystalline
• Melting Point: >640°C

Safety Information

• Storage Warning: Hygroscopic
• European Hazard Symbols: Irritant (Xi)
• Risk Statements: 36/37/38
• Safety Statements: 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%