3-(6-nitro-1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)phenyl acetate
Chemical Structure Depiction of
3-(6-nitro-1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)phenyl acetate
3-(6-nitro-1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)phenyl acetate
Compound characteristics
| Compound ID: | 8008-3542 |
| Compound Name: | 3-(6-nitro-1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)phenyl acetate |
| Molecular Weight: | 376.32 |
| Molecular Formula: | C20 H12 N2 O6 |
| Smiles: | CC(=O)Oc1cccc(c1)N1C(c2cccc3c(ccc(C1=O)c23)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.73 |
| logD: | 2.73 |
| logSw: | -3.6924 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 82.074 |
| InChI Key: | OLNLUYUTPMOILY-UHFFFAOYSA-N |