3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-5-carboxylic acid
Chemical Structure Depiction of
3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-5-carboxylic acid
3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-5-carboxylic acid
Compound characteristics
| Compound ID: | 8020-0670 |
| Compound Name: | 3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-5-carboxylic acid |
| Molecular Weight: | 193.16 |
| Molecular Formula: | C9 H7 N O4 |
| Smiles: | CN1C(=O)Oc2ccc(cc12)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.312 |
| logD: | -0.5053 |
| logSw: | -1.9355 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.512 |
| InChI Key: | LCLAZLIVBFONSJ-UHFFFAOYSA-N |