Aluminum Fluoride Monohydrate

• Catalog: OFC13462925
• CAS: 13462-92-5
• Category: Inorganic Fluorides
• Synonyms: Aluminum fluoride hydrate; Aluminium fluoride monohydrate
• Purity: >99%

• IUPAC Name: aluminum; trifluoride; hydrate
• InChI: InChI=1S/Al.3FH.H2O/h;3*1H;1H2/q+3;;;;/p-3
• InChI Key: XTXFDUABTPNTFB-UHFFFAOYSA-K
• Isomeric SMILES: O.F[Al](F)F
• Canonical SMILES: O.[F-].[F-].[F-].[Al+3]
• EC Number: 621-168-7

• Molecular Formula: H2AlF3O
• Molecular Weight: 101.99
• Melting Point: 250 °C
• Density: 2.17 g/mL
• Appearance: White powder or chunks

• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 0
• Exact Mass: 101.987313
• Monoisotopic Mass: 101.987313
• Topological Polar Surface Area: 1Ų
• Heavy Atom Count: 5
• Formal Charge: 0
• Complexity: 8