3,6,8-tribromo-7-hydroxy-4-methyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3,6,8-tribromo-7-hydroxy-4-methyl-2H-1-benzopyran-2-one
3,6,8-tribromo-7-hydroxy-4-methyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y500-0590 |
| Compound Name: | 3,6,8-tribromo-7-hydroxy-4-methyl-2H-1-benzopyran-2-one |
| Molecular Weight: | 412.86 |
| Molecular Formula: | C10 H5 Br3 O3 |
| Smiles: | CC1=C(C(=O)Oc2c1cc(c(c2[Br])O)[Br])[Br] |
| Stereo: | ACHIRAL |
| logP: | 4.1842 |
| logD: | 2.8441 |
| logSw: | -4.2407 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.324 |
| InChI Key: | KDNRKZZABHVBHS-UHFFFAOYSA-N |