4,4-Diphenyl-2,5-Cyclohexadien-1-One
[CAS# 13304-12-6]

Identification

• Name: 4,4-Diphenyl-2,5-Cyclohexadien-1-One
• Synonyms: 4,4-Di(Phenyl)-1-Cyclohexa-2,5-Dienone; 4,4-Diphenyl-2,5-Cyclohexadien-1-One; St5443408
• Molecular Formula: C₁₈H₁₄O
• Molecular Weight: 246.31
• CAS Registry Number: 13304-12-6
• SMILES: C1=CC=CC=C1C3(C2=CC=CC=C2)C=CC(=O)C=C3
• InChI: 1S/C18H14O/c19-17-11-13-18(14-12-17,15-7-3-1-4-8-15)16-9-5-2-6-10-16/h1-14H
• InChIKey: JUOUFRXTZODGAN-UHFFFAOYSA-N

Properties

• Density: 1.138g/cm³ (Cal.)
• Boiling point: 392.513°C at 760 mmHg (Cal.)
• Flash point: 171.63°C (Cal.)

References

• (1): Bartosz A. Grzybowski, Christopher E. Wilmer, Jiwon Kim, Kevin P. Browne and Kyle J. M. Bishop. Self-assembly: from crystals to cells, Soft Matter, 2009, 5, 1110.