S-[2-(4-bromophenyl)-2-oxoethyl] O-(propan-2-yl) carbonodithioate
Chemical Structure Depiction of
S-[2-(4-bromophenyl)-2-oxoethyl] O-(propan-2-yl) carbonodithioate
S-[2-(4-bromophenyl)-2-oxoethyl] O-(propan-2-yl) carbonodithioate
Compound characteristics
| Compound ID: | 2550-0275 |
| Compound Name: | S-[2-(4-bromophenyl)-2-oxoethyl] O-(propan-2-yl) carbonodithioate |
| Molecular Weight: | 333.26 |
| Molecular Formula: | C12 H13 Br O2 S2 |
| Smiles: | CC(C)OC(=S)SCC(c1ccc(cc1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 4.1162 |
| logD: | 4.1162 |
| logSw: | -4.2338 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 20.5672 |
| InChI Key: | BMIIVAPFHMDSKU-UHFFFAOYSA-N |