triammonium hexafluoroalumanetriuide

• ChemBase ID: 112283
• Molecular Formular: AlF6H12N3
• Molecular Mass: 195.0873372
• Monoisotopic Mass: 195.07508035
• SMILES: [NH4+].[NH4+].[NH4+].F[Al-3](F)(F)(F)(F)F
• Canonical SMILES: F[Al-3](F)(F)(F)(F)F.[NH4+].[NH4+].[NH4+]
• InChI: InChI=1S/Al.6FH.3H3N/h;6*1H;3*1H3/q+3;;;;;;;;;/p-3
• InChIKey: OYHBNKHFKHBTRQ-UHFFFAOYSA-K

NAMES AND DATABASE IDS

Names

• IUPAC name: triammonium hexafluoroalumanetriuide
• IUPAC Traditional name: triammonium hexafluoroalumanetriuide
• Synonyms: AMMONIUM HEXAFLUORO ALUMINATE; Ammonium aluminium fluoride; Ammonium hexafluoroaluminate

Database IDs

• CAS Number: 7784-19-2
• EC Number: 231-072-3
• PubChem SID: 162098161
• PubChem CID: 24565
• Chemspider ID: 11253835
• Wikipedia Title: Ammonium_hexafluoroaluminate

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 3.505
• LogD (pH = 7.4): 3.505
• Log P: 3.505
• Molar Refractivity: 9.0078 cm^3
• Polarizability: 4.7775145 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Apperance: White crystalline powder
• Melting Point: 126.1°C
• Boiling Point: 239.5°C
• Density: 1.78 g/cm^3 at 20°C

Safety Information

• RTECS: BD0050000
• European Hazard Symbols: Flammable (F)
• Risk Statements: R:15-17; R23/24/25
• Safety Statements: S:7/8; S26, S28, S36/37/39, S45
• Main Hazard: Irritant (Xi)
• NFPA704:
  

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DETAILS

MP Biomedicals - 05223328

MP Biomedicals Rare Chemical collection