2-[4-(hexyloxy)phenyl]-2-oxoethyl 4-(octyloxy)benzoate
Chemical Structure Depiction of
2-[4-(hexyloxy)phenyl]-2-oxoethyl 4-(octyloxy)benzoate
2-[4-(hexyloxy)phenyl]-2-oxoethyl 4-(octyloxy)benzoate
Compound characteristics
| Compound ID: | 0052-0065 |
| Compound Name: | 2-[4-(hexyloxy)phenyl]-2-oxoethyl 4-(octyloxy)benzoate |
| Molecular Weight: | 468.63 |
| Molecular Formula: | C29 H40 O5 |
| Smiles: | CCCCCCCCOc1ccc(cc1)C(=O)OCC(c1ccc(cc1)OCCCCCC)=O |
| Stereo: | ACHIRAL |
| logP: | 9.2271 |
| logD: | 9.2271 |
| logSw: | -5.9232 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.179 |
| InChI Key: | YEMMUIYSEKNHKL-UHFFFAOYSA-N |