3,6-dichloro-2-methyl-1H-1-benzothiophene-1,1-dione
Chemical Structure Depiction of
3,6-dichloro-2-methyl-1H-1-benzothiophene-1,1-dione
3,6-dichloro-2-methyl-1H-1-benzothiophene-1,1-dione
Compound characteristics
| Compound ID: | Y204-5780 |
| Compound Name: | 3,6-dichloro-2-methyl-1H-1-benzothiophene-1,1-dione |
| Molecular Weight: | 249.11 |
| Molecular Formula: | C9 H6 Cl2 O2 S |
| Smiles: | CC1=C(c2ccc(cc2S1(=O)=O)[Cl])[Cl] |
| Stereo: | ACHIRAL |
| logP: | 2.9529 |
| logD: | 2.9529 |
| logSw: | -3.3945 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 29.5052 |
| InChI Key: | CTPRGOXKDZZTJE-UHFFFAOYSA-N |