dimethyl 6-nitro-1,1-dioxo-1,2-dihydro-3H-1lambda~6~,3-benzothiazole-2,3-dicarboxylate
Chemical Structure Depiction of
dimethyl 6-nitro-1,1-dioxo-1,2-dihydro-3H-1lambda~6~,3-benzothiazole-2,3-dicarboxylate
dimethyl 6-nitro-1,1-dioxo-1,2-dihydro-3H-1lambda~6~,3-benzothiazole-2,3-dicarboxylate
Compound characteristics
| Compound ID: | 8010-7798 |
| Compound Name: | dimethyl 6-nitro-1,1-dioxo-1,2-dihydro-3H-1lambda~6~,3-benzothiazole-2,3-dicarboxylate |
| Molecular Weight: | 330.27 |
| Molecular Formula: | C11 H10 N2 O8 S |
| Smiles: | COC(C1N(C(=O)OC)c2ccc(cc2S1(=O)=O)[N+]([O-])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.507 |
| logD: | 0.507 |
| logSw: | -2.1289 |
| Hydrogen bond acceptors count: | 14 |
| Polar surface area: | 105.52 |
| InChI Key: | MCTRITRIXRFPGF-VIFPVBQESA-N |