2-oxo-2H-1,3-benzoxathiol-5-yl 4-bromobenzoate
Chemical Structure Depiction of
2-oxo-2H-1,3-benzoxathiol-5-yl 4-bromobenzoate
2-oxo-2H-1,3-benzoxathiol-5-yl 4-bromobenzoate
Compound characteristics
| Compound ID: | 2729-1011 |
| Compound Name: | 2-oxo-2H-1,3-benzoxathiol-5-yl 4-bromobenzoate |
| Molecular Weight: | 351.17 |
| Molecular Formula: | C14 H7 Br O4 S |
| Smiles: | c1cc(ccc1C(=O)Oc1ccc2c(c1)SC(=O)O2)[Br] |
| Stereo: | ACHIRAL |
| logP: | 3.8661 |
| logD: | 3.8661 |
| logSw: | -4.1902 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 42.688 |
| InChI Key: | FYOVIQWVSMRHCT-UHFFFAOYSA-N |