aluminium(3+) ion triboranuide

• ChemBase ID: 125742
• Molecular Formular: AlB3
• Molecular Mass: 59.414538
• Monoisotopic Mass: 60.00945483
• SMILES: [AlH3+3].[BH3-].[BH3-].[BH3-]
• Canonical SMILES: [BH3-].[BH3-].[BH3-].[AlH3+3]
• InChI: InChI=1S/Al.3BH4/h;3*1H4/q+3;3*-1
• InChIKey: LNJYEMMRSAGORU-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: aluminium(3+) ion triboranuide
• IUPAC Traditional name: aluminium(3+) ion triboranuide
• Synonyms: Aluminum borohydride; aluminium tetrahydroborate; aluminum tetrahydroborate; Aluminium borohydride

Database IDs

• CAS Number: 16962-07-5
• PubChem SID: 162220092
• PubChem CID: 6328559
• Chemspider ID: 55734
• Wikipedia Title: Aluminium_borohydride

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 1.45
• LogD (pH = 7.4): 1.45
• Log P: 1.45
• Molar Refractivity: 0.0 cm^3
• Polarizability: 2.1671338 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Solubility: reacts in water
• Apperance: colorless liquid
• Melting Point: -64.5°C
• Boiling Point: 44.5°C
• Flash Point: Spontaneously ignites