4-{[2-bromo-4-(hydroxymethyl)-6-methoxyphenoxy]methyl}benzoic acid
Chemical Structure Depiction of
4-{[2-bromo-4-(hydroxymethyl)-6-methoxyphenoxy]methyl}benzoic acid
4-{[2-bromo-4-(hydroxymethyl)-6-methoxyphenoxy]methyl}benzoic acid
Compound characteristics
| Compound ID: | 6415-0057 |
| Compound Name: | 4-{[2-bromo-4-(hydroxymethyl)-6-methoxyphenoxy]methyl}benzoic acid |
| Molecular Weight: | 367.19 |
| Molecular Formula: | C16 H15 Br O5 |
| Smiles: | COc1cc(CO)cc(c1OCc1ccc(cc1)C(O)=O)[Br] |
| Stereo: | ACHIRAL |
| logP: | 3.2805 |
| logD: | 0.309 |
| logSw: | -3.2022 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.793 |
| InChI Key: | PEGJVTINIIQLGE-UHFFFAOYSA-N |