5-[(4-chloro-3,5-dimethylphenoxy)methyl]furan-2-carboxylic acid
Chemical Structure Depiction of
5-[(4-chloro-3,5-dimethylphenoxy)methyl]furan-2-carboxylic acid
5-[(4-chloro-3,5-dimethylphenoxy)methyl]furan-2-carboxylic acid
Compound characteristics
| Compound ID: | Y507-0058 |
| Compound Name: | 5-[(4-chloro-3,5-dimethylphenoxy)methyl]furan-2-carboxylic acid |
| Molecular Weight: | 280.71 |
| Molecular Formula: | C14 H13 Cl O4 |
| Smiles: | Cc1cc(cc(C)c1[Cl])OCc1ccc(C(O)=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 3.8943 |
| logD: | -0.0897 |
| logSw: | -3.9021 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.715 |
| InChI Key: | PKAGAGHZBLSWLS-UHFFFAOYSA-N |