tert-butyl [(2-oxo-2H-1,3-benzoxathiol-5-yl)oxy]acetate
Chemical Structure Depiction of
tert-butyl [(2-oxo-2H-1,3-benzoxathiol-5-yl)oxy]acetate
tert-butyl [(2-oxo-2H-1,3-benzoxathiol-5-yl)oxy]acetate
Compound characteristics
| Compound ID: | 8007-3603 |
| Compound Name: | tert-butyl [(2-oxo-2H-1,3-benzoxathiol-5-yl)oxy]acetate |
| Molecular Weight: | 282.31 |
| Molecular Formula: | C13 H14 O5 S |
| Smiles: | CC(C)(C)OC(COc1ccc2c(c1)SC(=O)O2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6834 |
| logD: | 2.6834 |
| logSw: | -2.8852 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 49.078 |
| InChI Key: | NTTOIFVDDWFCAI-UHFFFAOYSA-N |