λ5-bismuthio(3+) ion trialumanoylolate

• ChemBase ID: 149384
• Molecular Formular: Al3BiH3O6
• Molecular Mass: 388.945234
• Monoisotopic Mass: 388.91797671
• SMILES: [O-][AlH]=O.[O-][AlH]=O.[O-][AlH]=O.[Bi+3]
• Canonical SMILES: [O-][AlH]=O.[O-][AlH]=O.[O-][AlH]=O.[Bi+3]
• InChI: InChI=1S/3Al.Bi.6O/q;;;+3;;;;3*-1
• InChIKey: ZWSUTHPTOGDVHM-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: λ^5-bismuthio(3+) ion trialumanoylolate
• IUPAC Traditional name: λ^5-bismuthio(3+) ion trialumanoylolate
• Synonyms: Aluminum bismuth oxide hydrate; Bismuth aluminate hydrate; 氧化铝铋 水合物; 铝酸铋 水合物

Database IDs

• CAS Number: 308796-32-9
• EC Number: 235-552-3
• MDL Number: MFCD00672141
• PubChem SID: 162243550; 24873490
• PubChem CID: 21863082

CALCULATED PROPERTIES

• Acid pKa: 3.0
• H Acceptors: 2
• H Donor: 0
• LogD (pH = 5.5): -1.5039775
• LogD (pH = 7.4): -1.698255
• Log P: 0.5624
• Molar Refractivity: 2.8858 cm^3
• Polarizability: 3.6723542 Å^3
• Polar Surface Area: 40.13 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Safety Information

• German water hazard class: 3
• Personal Protective Equipment: Eyeshields, Gloves, type N95 (US), type P1 (EN143) respirator filter

Product Information

• Purity: ≥99.9%
• Linear Formula: Bi2(Al2O4)3 · xH2O

DETAILS

Sigma Aldrich - 510289

Packaging
500 g in glass bottle