tribromopraseodymium hydrate

• ChemBase ID: 152968
• Molecular Formular: Br3H2OPr
• Molecular Mass: 398.63493
• Monoisotopic Mass: 395.67322768
• SMILES: O.Br[Pr](Br)Br
• Canonical SMILES: Br[Pr](Br)Br.O
• InChI: InChI=1S/3BrH.H2O.Pr/h3*1H;1H2;/q;;;;+3/p-3
• InChIKey: CCMZJPMVOCFMPN-UHFFFAOYSA-K

NAMES AND DATABASE IDS

Names

• IUPAC name: tribromopraseodymium hydrate
• IUPAC Traditional name: tribromopraseodymium hydrate
• Synonyms: Praseodymium(III) bromide hydrate; 溴化镨(III) 水合物

Database IDs

• CAS Number: 225505-12-4
• EC Number: 236-893-0
• MDL Number: MFCD00748138
• PubChem SID: 162247109; 24880794
• PubChem CID: 16217298

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 2.8053
• LogD (pH = 7.4): 2.8053
• Log P: 2.8053
• Molar Refractivity: 26.2056 cm^3
• Polarizability: 16.76374 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Apperance: chunks

Safety Information

• European Hazard Symbols: Irritant (Xi)
• German water hazard class: 3
• Risk Statements: 36
• Safety Statements: 26-36
• GHS Pictograms: GHS07
• GHS Signal Word: Warning
• GHS Hazard statements: H319
• GHS Precautionary statements: P305 + P351 + P338
• Personal Protective Equipment: dust mask type N95 (US), Eyeshields, Gloves

Product Information

• Purity: ≥99.99% trace metals basis
• Linear Formula: PrBr3 · xH2O

DETAILS

Sigma Aldrich - 575267

Packaging
5 g in glass bottle