4-butyl-7,8-dihydroxy-2H-1-benzopyran-2-one
Chemical Structure Depiction of
4-butyl-7,8-dihydroxy-2H-1-benzopyran-2-one
4-butyl-7,8-dihydroxy-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | D715-2429 |
| Compound Name: | 4-butyl-7,8-dihydroxy-2H-1-benzopyran-2-one |
| Molecular Weight: | 234.25 |
| Molecular Formula: | C13 H14 O4 |
| Smiles: | CCCCC1=CC(=O)Oc2c1ccc(c2O)O |
| Stereo: | ACHIRAL |
| logP: | 2.9652 |
| logD: | 2.8656 |
| logSw: | -3.1494 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 52.357 |
| InChI Key: | GDGBIWNBPUQGGZ-UHFFFAOYSA-N |