6,7-dinitro-1H,3H-naphtho[1,8-cd]pyran-1,3-dione
Chemical Structure Depiction of
6,7-dinitro-1H,3H-naphtho[1,8-cd]pyran-1,3-dione
6,7-dinitro-1H,3H-naphtho[1,8-cd]pyran-1,3-dione
Compound characteristics
| Compound ID: | 0109-0211 |
| Compound Name: | 6,7-dinitro-1H,3H-naphtho[1,8-cd]pyran-1,3-dione |
| Molecular Weight: | 288.17 |
| Molecular Formula: | C12 H4 N2 O7 |
| Smiles: | c1cc(c2c(ccc3C(=O)OC(c1c23)=O)[N+]([O-])=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.2356 |
| logD: | 2.2356 |
| logSw: | -2.9311 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 100.886 |
| InChI Key: | FQRCSJLFCQWWBV-UHFFFAOYSA-N |