3-hydroxy-4-pentanoylphenyl 4-(octyloxy)benzoate
Chemical Structure Depiction of
3-hydroxy-4-pentanoylphenyl 4-(octyloxy)benzoate
3-hydroxy-4-pentanoylphenyl 4-(octyloxy)benzoate
Compound characteristics
| Compound ID: | 0164-0066 |
| Compound Name: | 3-hydroxy-4-pentanoylphenyl 4-(octyloxy)benzoate |
| Molecular Weight: | 426.55 |
| Molecular Formula: | C26 H34 O5 |
| Smiles: | CCCCCCCCOc1ccc(cc1)C(=O)Oc1ccc(C(CCCC)=O)c(c1)O |
| Stereo: | ACHIRAL |
| logP: | 8.0766 |
| logD: | 8.0117 |
| logSw: | -5.5814 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.829 |
| InChI Key: | YXGDCQVNUOMIRC-UHFFFAOYSA-N |