bis(4-phenylphenyl)methanone

• ChemBase ID: 107620
• Molecular Formular: C25H18O
• Molecular Mass: 334.40982
• Monoisotopic Mass: 334.1357652
• SMILES: O=C(c1ccc(cc1)c1ccccc1)c1ccc(cc1)c1ccccc1
• Canonical SMILES: O=C(c1ccc(cc1)c1ccccc1)c1ccc(cc1)c1ccccc1
• InChI: InChI=1S/C25H18O/c26-25(23-15-11-21(12-16-23)19-7-3-1-4-8-19)24-17-13-22(14-18-24)20-9-5-2-6-10-20/h1-18H
• InChIKey: QRQHCGWCUVLPSQ-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: bis(4-phenylphenyl)methanone
• IUPAC Traditional name: bis(4-phenylphenyl)methanone
• Synonyms: Di-4-biphenylyl ketone; 4,4'-Diphenylbenzophenone; 4,4'-DIPHENYLBENZOPHENONE; 4,4'-联苯苯甲酮

Database IDs

• CAS Number: 3478-90-8
• MDL Number: MFCD00016575
• Beilstein Number: 1885447
• PubChem SID: 162093670
• PubChem CID: 228453

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 0
• LogD (pH = 5.5): 6.7270494
• LogD (pH = 7.4): 6.7270494
• Log P: 6.7270494
• Molar Refractivity: 106.9059 cm^3
• Polarizability: 44.2439 Å^3
• Polar Surface Area: 17.07 Å^2
• Rotatable Bonds: 4
• Lipinski's Rule of Five: false

PROPERTIES

Physical Property

• Melting Point: 235-240°C

Safety Information

• TSCA Listed: 否

Product Information

• Purity: 97%

DETAILS

MP Biomedicals - 05204372

MP Biomedicals Rare Chemical collection