(6-nitro-1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)acetic acid
Chemical Structure Depiction of
(6-nitro-1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)acetic acid
(6-nitro-1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)acetic acid
Compound characteristics
| Compound ID: | 8003-3759 |
| Compound Name: | (6-nitro-1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)acetic acid |
| Molecular Weight: | 300.22 |
| Molecular Formula: | C14 H8 N2 O6 |
| Smiles: | C(C(O)=O)N1C(c2cccc3c(ccc(C1=O)c23)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.7497 |
| logD: | -3.4913 |
| logSw: | -2.5285 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.59 |
| InChI Key: | NZFZKMVXWPQWCN-UHFFFAOYSA-N |