tetrafluoroboranuide; tetraphenylphosphanium

• ChemBase ID: 93394
• Molecular Formular: C24H20BF4P
• Molecular Mass: 426.1939738
• Monoisotopic Mass: 426.13318055
• SMILES: [P+](c1ccccc1)(c1ccccc1)(c1ccccc1)c1ccccc1.[B-](F)(F)(F)F
• Canonical SMILES: c1ccc(cc1)[P+](c1ccccc1)(c1ccccc1)c1ccccc1.F[B-](F)(F)F
• InChI: InChI=1S/C24H20P.BF4/c1-5-13-21(14-6-1)25(22-15-7-2-8-16-22,23-17-9-3-10-18-23)24-19-11-4-12-20-24;2-1(3,4)5/h1-20H;/q+1;-1
• InChIKey: MAJBFAYVSDYMQG-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: tetrafluoroboranuide; tetraphenylphosphanium
• IUPAC Traditional name: tetraphenylphosphonium tetrafluoroborate
• Synonyms: Tetrakis(phenyl)phosphonium tetrafluoroborate; Tetraphenylphosphonium tetrafluoroborate; 四苯基四氟硼酸磷鎓

Database IDs

• CAS Number: 426-79-9
• EC Number: 207-044-1
• MDL Number: MFCD00051889
• Beilstein Number: 3834618
• PubChem SID: 162080079
• PubChem CID: 2734204

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 6.0781937
• LogD (pH = 7.4): 6.0781937
• Log P: 6.0781937
• Molar Refractivity: 107.0972 cm^3
• Polarizability: 42.196945 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 4
• Lipinski's Rule of Five: false

PROPERTIES

Physical Property

• Melting Point: >300°C; >300°C

Safety Information

• Storage Warning: Irritant
• European Hazard Symbols: Irritant (Xi)
• Risk Statements: 36/37/38
• Safety Statements: 26-37
• TSCA Listed: 否
• GHS Pictograms: GHS07
• GHS Hazard statements: H315-H319-H335
• GHS Precautionary statements: P280G-P305+P351+P338

Product Information

• Purity: 98+%