1,3-Dibenzoylbenzene

1,3-Dibenzoylbenzene ([3-(benzoyl)phenyl]-phenyl-methanone, m-Dibenzoylbenzene) is a diarylketone derivative. It has topologically pseudogenerate Π-LUMO′s (lowest unoccupied molecular orbital). Its synthesis from benzene has been reported. Crystal structure studies suggest that its crystals are orthorhombic and exhibit space goup Pbca.

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Catalog Number CBB1121312
Molecular Formula C6H4(COC6H5)2
CAS# 3770-82-9
Purity >98%
Inchi 1S/C20H14O2/c21-19(15-8-3-1-4-9-15)17-12-7-13-18(14-17)20(22)16-10-5-2-6-11-16/h1-14H
Inchi Key MJQHDSIEDGPFAM-UHFFFAOYSA-N
SMILES O=C(c1ccccc1)c2cccc(c2)C(=O)c3ccccc3
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