1-(4-Methylphenyl)-2-Phenyl-Ethanone
[CAS# 2001-28-7]

Identification

• Classification: Flavors and spices >> Synthetic spice >> Ketone fragrance >> Aromatic ketone fragrance
• Name: 1-(4-Methylphenyl)-2-Phenyl-Ethanone
• Synonyms: 1-(4-Methylphenyl)-2-Phenyl-Ethanone; Zinc02566123; Ae-641/00345036
• Molecular Formula: C₁₅H₁₄O
• Molecular Weight: 210.28
• CAS Registry Number: 2001-28-7
• SMILES: C2=C(C(CC1=CC=CC=C1)=O)C=CC(=C2)C
• InChI: 1S/C15H14O/c1-12-7-9-14(10-8-12)15(16)11-13-5-3-2-4-6-13/h2-10H,11H2,1H3
• InChIKey: RDBAEHHVVNBKBB-UHFFFAOYSA-N

Properties

• Density: 1.062g/cm³ (Cal.)
• Boiling point: 343.007°C at 760 mmHg (Cal.)
• Flash point: 147.732°C (Cal.)

References

• (1): Simin Liu and Bruce C. Gibb. High-definition self-assemblies driven by the hydrophobic effect: synthesis and properties of a supramolecular nanocapsule, Chem. Commun., 2008, 3709.