[4-(6-bromo-2-oxo-2H-1-benzopyran-3-yl)phenoxy]acetic acid
Chemical Structure Depiction of
[4-(6-bromo-2-oxo-2H-1-benzopyran-3-yl)phenoxy]acetic acid
[4-(6-bromo-2-oxo-2H-1-benzopyran-3-yl)phenoxy]acetic acid
Compound characteristics
| Compound ID: | Y041-3716 |
| Compound Name: | [4-(6-bromo-2-oxo-2H-1-benzopyran-3-yl)phenoxy]acetic acid |
| Molecular Weight: | 375.17 |
| Molecular Formula: | C17 H11 Br O5 |
| Smiles: | C(C(O)=O)Oc1ccc(cc1)C1=Cc2cc(ccc2OC1=O)[Br] |
| Stereo: | ACHIRAL |
| logP: | 3.3392 |
| logD: | -0.8978 |
| logSw: | -3.5196 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.771 |
| InChI Key: | KEHQDCWUXOPZMQ-UHFFFAOYSA-N |