3-[(3,4-dimethylphenyl)imino]-2-nitro-2,3-dihydro-1H-inden-1-one
Chemical Structure Depiction of
3-[(3,4-dimethylphenyl)imino]-2-nitro-2,3-dihydro-1H-inden-1-one
3-[(3,4-dimethylphenyl)imino]-2-nitro-2,3-dihydro-1H-inden-1-one
Compound characteristics
| Compound ID: | 8006-1631 |
| Compound Name: | 3-[(3,4-dimethylphenyl)imino]-2-nitro-2,3-dihydro-1H-inden-1-one |
| Molecular Weight: | 294.31 |
| Molecular Formula: | C17 H14 N2 O3 |
| Smiles: | Cc1ccc(cc1C)/N=C1C(C(c2ccccc/12)=O)[N+]([O-])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8259 |
| logD: | -7.9001 |
| logSw: | -3.9337 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.36 |
| InChI Key: | IUKDWZCHNGRLBG-INIZCTEOSA-N |