4-(1-Pyrenyl)Butyl Methylphosphonofluoridate
[CAS# 67000-88-8]

Identification

• Name: 4-(1-Pyrenyl)Butyl Methylphosphonofluoridate
• Synonyms: 1-[4-(Fluoro-Methyl-Phosphoryl)Oxybutyl]Pyrene; Brn 2163126; Methylphosphonofluoridic Acid 4-(1-Pyrenyl)Butyl Ester
• Molecular Formula: C₂₁H₂₀FO₂P
• Molecular Weight: 354.36
• CAS Registry Number: 67000-88-8
• SMILES: C3=CC1=CC=CC2=CC=C4C(=C12)C3=C(C=C4)CCCCO[P](F)(=O)C
• InChI: 1S/C21H20FO2P/c1-25(22,23)24-14-3-2-5-15-8-9-18-11-10-16-6-4-7-17-12-13-19(15)21(18)20(16)17/h4,6-13H,2-3,5,14H2,1H3
• InChIKey: VSWBPUDGAWYALA-UHFFFAOYSA-N

Properties

• Density: 1.264g/cm³ (Cal.)
• Boiling point: 537.444°C at 760 mmHg (Cal.)
• Flash point: 278.836°C (Cal.)