4,4-Diphenyl-2-butanone

• CAS: 5409-60-9
• Catalog Number: ACM5409609
• Category: Other Products
• Molecular Weight: 224.3
• Molecular Formula: C₁₆H₁₆O
• Synonyms: 1,1-Diphenyl-3-butanone
• IUPAC Name: 4,4-Diphenylbutan-2-one
• Canonical SMILES: CC(=O)CC(C1=CC=CC=C1)C2=CC=CC=C2
• InChI: InChI=1S/C16H16O/c1-13(17)12-16(14-8-4-2-5-9-14)15-10-6-3-7-11-15/h2-11,16H,12H2,1H3
• InChI Key: FPHXYKLKNOEKTQ-UHFFFAOYSA-N
• Boiling Point: 164.5-168 °C
• Melting Point: 170-171 °C
• Flash Point: 139.7ºC
• Density: 1.037±0.06 g/cm³
• EC Number: 226-482-4
• Exact Mass: 224.12011513
• H-Bond Acceptor: 1
• H-Bond Donor: 0
• Monoisotopic Mass: 224.12011513
• Topological Polar Surface Area: 17.1 Ų