2-[4-(octyloxy)phenyl]-2-oxoethyl 4-hexylbenzoate
Chemical Structure Depiction of
2-[4-(octyloxy)phenyl]-2-oxoethyl 4-hexylbenzoate
2-[4-(octyloxy)phenyl]-2-oxoethyl 4-hexylbenzoate
Compound characteristics
| Compound ID: | 0052-0074 |
| Compound Name: | 2-[4-(octyloxy)phenyl]-2-oxoethyl 4-hexylbenzoate |
| Molecular Weight: | 452.63 |
| Molecular Formula: | C29 H40 O4 |
| Smiles: | CCCCCCCCOc1ccc(cc1)C(COC(c1ccc(CCCCCC)cc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 9.7683 |
| logD: | 9.7683 |
| logSw: | -5.8423 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.761 |
| InChI Key: | DMDAYNGTSUBDFF-UHFFFAOYSA-N |