4-phenyloxane-4-carboxylic acid
Chemical Structure Depiction of
4-phenyloxane-4-carboxylic acid
4-phenyloxane-4-carboxylic acid
Compound characteristics
| Compound ID: | Y041-0426 |
| Compound Name: | 4-phenyloxane-4-carboxylic acid |
| Molecular Weight: | 206.24 |
| Molecular Formula: | C12 H14 O3 |
| Smiles: | C1COCCC1(C(O)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 1.5693 |
| logD: | -0.8056 |
| logSw: | -1.5166 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.476 |
| InChI Key: | BWHJLSRDMNLSET-UHFFFAOYSA-N |