3-formyl-4-oxo-4H-1-benzopyran-6-yl acetate
Chemical Structure Depiction of
3-formyl-4-oxo-4H-1-benzopyran-6-yl acetate
3-formyl-4-oxo-4H-1-benzopyran-6-yl acetate
Compound characteristics
| Compound ID: | 8018-8711 |
| Compound Name: | 3-formyl-4-oxo-4H-1-benzopyran-6-yl acetate |
| Molecular Weight: | 232.19 |
| Molecular Formula: | C12 H8 O5 |
| Smiles: | CC(=O)Oc1ccc2c(c1)C(C(=CO2)C=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.851 |
| logD: | 0.851 |
| logSw: | -2.2708 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 56.042 |
| InChI Key: | LEBXNPPDAKBRIZ-UHFFFAOYSA-N |