2-(1,3-benzoxazol-2-yl)-4-methylphenyl ethanesulfonate
Chemical Structure Depiction of
2-(1,3-benzoxazol-2-yl)-4-methylphenyl ethanesulfonate
2-(1,3-benzoxazol-2-yl)-4-methylphenyl ethanesulfonate
Compound characteristics
| Compound ID: | V015-9544 |
| Compound Name: | 2-(1,3-benzoxazol-2-yl)-4-methylphenyl ethanesulfonate |
| Molecular Weight: | 317.36 |
| Molecular Formula: | C16 H15 N O4 S |
| Smiles: | CCS(=O)(=O)Oc1ccc(C)cc1c1nc2ccccc2o1 |
| Stereo: | ACHIRAL |
| logP: | 3.6373 |
| logD: | 3.6373 |
| logSw: | -3.7813 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.244 |
| InChI Key: | HOCPHDVLEAPFOU-UHFFFAOYSA-N |