| Phytochemical Name : 1,2-Dibenzoylethane |
| PCNDIDOT0324 |
| Pubchem CID : 136322 |
| Molecular formula: C16H14O2 |
| Canonical SMILES : C1=CC=C(C=C1)C(=O)CCC(=O)C2=CC=CC=C2 |
Synonymes : 1,2-Dibenzoylethane|495-71-6|1,4-diphenylbutane-1,4-dione|1,4-Diphenyl-1,4-butanedione|1,4-Butanedione, 1,4-diphenyl-|Diphenacyl|1,4-diphenyl-butane-1,4-dione|MFCD00037818|Succinophenone (Diphenacyl)|Biphenacyl|2,2''-Biacetophenone|1,4-Diphenyl-1,4-butadione|NSC402168|NSC 402168|3-Benzoyl propiophenone|Ethane, 1,2-dibenzoyl-|Cambridge id 5102527|Oprea1_385312|CBDivE_002049|SCHEMBL719034|1,4-dipheny-1,4-butanedione|CHEMBL4215633|DTXSID30197811|HMS1577I15|STK328100|1,4-diphenylbutane-1,4-dione (en)|AKOS004907792|CS-W012837|NSC-402168|AS-10094|D3179|FT-0606339|A827751|Q63398457 |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 2.120 |
| Log Po/w (XLOGP3) : 2.850 |
| Log Po/w (WLOGP) : 3.530 |
| Log Po/w (MLOGP) : 2.760 |
| Log Po/w (SILICOS-IT) : 4.020 |
| Consensus Log Po/w : 3.060 |