3-[(2,5-dimethylphenoxy)methyl]benzoic acid
Chemical Structure Depiction of
3-[(2,5-dimethylphenoxy)methyl]benzoic acid
3-[(2,5-dimethylphenoxy)methyl]benzoic acid
Compound characteristics
| Compound ID: | Y503-2314 |
| Compound Name: | 3-[(2,5-dimethylphenoxy)methyl]benzoic acid |
| Molecular Weight: | 256.3 |
| Molecular Formula: | C16 H16 O3 |
| Smiles: | Cc1ccc(C)c(c1)OCc1cccc(c1)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4141 |
| logD: | 1.5166 |
| logSw: | -4.4416 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 35.961 |
| InChI Key: | ITFXKOJEFYEIJC-UHFFFAOYSA-N |