holmium(3+) ion hydrate tribromide

• ChemBase ID: 302961
• Molecular Formular: Br3HoO
• Molecular Mass: 420.64172
• Monoisotopic Mass: 417.68024762
• SMILES: O.[Br-].[Br-].[Br-].[Ho+3]
• Canonical SMILES: O.[Br-].[Br-].[Br-].[Ho+3]
• InChI: InChI=1S/3BrH.Ho.H2O/h3*1H;;1H2/q;;;+3;/p-3
• InChIKey: ZSFPAAHZCBVDRA-UHFFFAOYSA-K

NAMES AND DATABASE IDS

Names

• IUPAC name: holmium(3+) ion hydrate tribromide
• IUPAC Traditional name: holmium(3+) ion hydrate tribromide
• Synonyms: Holmium(III) bromide hydrate, REacton®; 溴化钬(III)水合物, REacton®

Database IDs

• CAS Number: 223911-98-6
• EC Number: 237-524-6
• MDL Number: MFCD00209652
• Merck Index: 144727

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: 914°C

Safety Information

• Storage Warning: Hygroscopic
• European Hazard Symbols: Irritant (Xi)
• Risk Statements: 36/37/38
• Safety Statements: 26
• 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: 99.99% (REO)