2-methyloctahydro-1-benzothiopyran-1,1,4-trione
Chemical Structure Depiction of
2-methyloctahydro-1-benzothiopyran-1,1,4-trione
2-methyloctahydro-1-benzothiopyran-1,1,4-trione
Compound characteristics
| Compound ID: | 8016-5382 |
| Compound Name: | 2-methyloctahydro-1-benzothiopyran-1,1,4-trione |
| Molecular Weight: | 216.3 |
| Molecular Formula: | C10 H16 O3 S |
| Smiles: | CC1CC(C2CCCCC2S1(=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.5406 |
| logD: | 1.5406 |
| logSw: | -2.1953 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 42.579 |
| InChI Key: | JTTNICREZFUTGU-JEUQWKINSA-N |