(2-benzoylphenyl)(phenyl)methanone

• ChemBase ID: 108534
• Molecular Formular: C20H14O2
• Molecular Mass: 286.32396
• Monoisotopic Mass: 286.09937969
• SMILES: O=C(c1ccccc1)c1ccccc1C(=O)c1ccccc1
• Canonical SMILES: O=C(c1ccccc1C(=O)c1ccccc1)c1ccccc1
• InChI: InChI=1S/C20H14O2/c21-19(15-9-3-1-4-10-15)17-13-7-8-14-18(17)20(22)16-11-5-2-6-12-16/h1-14H
• InChIKey: OJLABXSUFRIXFL-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: (2-benzoylphenyl)(phenyl)methanone
• IUPAC Traditional name: (2-benzoylphenyl)(phenyl)methanone
• Synonyms: o-DIBENZOYLBENZENE; 2-Benzoylbenzophenone; 1,2-Dibenzoylbenzene; 1,2-Phenylenebis(phenylmethanone); 1,2-联苯甲酰苯

Database IDs

• CAS Number: 1159-86-0
• EC Number: 214-597-2
• MDL Number: MFCD00003078
• Beilstein Number: 789077
• PubChem SID: 162095639
• PubChem CID: 70875

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 0
• LogD (pH = 5.5): 4.891952
• LogD (pH = 7.4): 4.891952
• Log P: 4.891952
• Molar Refractivity: 87.209 cm^3
• Polarizability: 33.678883 Å^3
• Polar Surface Area: 34.14 Å^2
• Rotatable Bonds: 4
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Melting Point: 145-148°C

Safety Information

• TSCA Listed: 否

Product Information

• Purity: 97%

DETAILS

MP Biomedicals - 05207722

MP Biomedicals Rare Chemical collection