3,7-dinitro-5H-5lambda~6~-dibenzo[b,d]thiophene-5,5-dione
Chemical Structure Depiction of
3,7-dinitro-5H-5lambda~6~-dibenzo[b,d]thiophene-5,5-dione
3,7-dinitro-5H-5lambda~6~-dibenzo[b,d]thiophene-5,5-dione
Compound characteristics
| Compound ID: | 0382-0061 |
| Compound Name: | 3,7-dinitro-5H-5lambda~6~-dibenzo[b,d]thiophene-5,5-dione |
| Molecular Weight: | 306.25 |
| Molecular Formula: | C12 H6 N2 O6 S |
| Smiles: | c1cc2c3ccc(cc3S(c2cc1[N+]([O-])=O)(=O)=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.6336 |
| logD: | 2.6336 |
| logSw: | -3.207 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 95.997 |
| InChI Key: | YRXRGRLSHSSUNF-UHFFFAOYSA-N |