3-(2-oxo-1,3-benzoxazol-3(2H)-yl)propanoic acid
Chemical Structure Depiction of
3-(2-oxo-1,3-benzoxazol-3(2H)-yl)propanoic acid
3-(2-oxo-1,3-benzoxazol-3(2H)-yl)propanoic acid
Compound characteristics
| Compound ID: | N013-0007 |
| Compound Name: | 3-(2-oxo-1,3-benzoxazol-3(2H)-yl)propanoic acid |
| Molecular Weight: | 207.18 |
| Molecular Formula: | C10 H9 N O4 |
| Smiles: | C(CN1C(=O)Oc2ccccc12)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.4492 |
| logD: | -2.0577 |
| logSw: | -1.4114 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.701 |
| InChI Key: | BMLRDVCKJXMASM-UHFFFAOYSA-N |