3-chloro-5,7-dihydroxy-4-methyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-chloro-5,7-dihydroxy-4-methyl-2H-1-benzopyran-2-one
3-chloro-5,7-dihydroxy-4-methyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | D715-2422 |
| Compound Name: | 3-chloro-5,7-dihydroxy-4-methyl-2H-1-benzopyran-2-one |
| Molecular Weight: | 226.61 |
| Molecular Formula: | C10 H7 Cl O4 |
| Smiles: | CC1=C(C(=O)Oc2cc(cc(c12)O)O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 2.1219 |
| logD: | 1.3602 |
| logSw: | -2.33 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.325 |
| InChI Key: | AHJNZRDMIZWOFG-UHFFFAOYSA-N |