| Phytochemical Name : 1H-Inden-1-one, 2-diazo-2,3-dihydro-3-methyl- |
| PCNDIDOT0414 |
| Pubchem CID : 575466 |
| Molecular formula: C10H8N2O |
| Canonical SMILES : CC1C2=CC=CC=C2C(=O)C1=[N+]=[N-] |
Synonymes : 1H-Inden-1-one, 2-diazo-2,3-dihydro-3-methyl-|54789-38-7|2-Diazo-2,3-dihydro-3-methyl-1H-inden-1-one |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 1.940 |
| Log Po/w (XLOGP3) : 1.860 |
| Log Po/w (WLOGP) : 1.660 |
| Log Po/w (MLOGP) : 0.840 |
| Log Po/w (SILICOS-IT) : 1.190 |
| Consensus Log Po/w : 1.500 |