1lambda~6~-thiepane-1,1,4-trione
Chemical Structure Depiction of
1lambda~6~-thiepane-1,1,4-trione
1lambda~6~-thiepane-1,1,4-trione
Compound characteristics
| Compound ID: | 0413-0221 |
| Compound Name: | 1lambda~6~-thiepane-1,1,4-trione |
| Molecular Weight: | 162.2 |
| Molecular Formula: | C6 H10 O3 S |
| Smiles: | C1CC(CCS(C1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | -1.0491 |
| logD: | -1.0491 |
| logSw: | -0.5461 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 42.182 |
| InChI Key: | KDZIXNJWKFGGSI-UHFFFAOYSA-N |