4-cyanophenyl 4-heptylbenzoate
Chemical Structure Depiction of
4-cyanophenyl 4-heptylbenzoate
4-cyanophenyl 4-heptylbenzoate
Compound characteristics
| Compound ID: | 0054-0204 |
| Compound Name: | 4-cyanophenyl 4-heptylbenzoate |
| Molecular Weight: | 321.42 |
| Molecular Formula: | C21 H23 N O2 |
| Smiles: | CCCCCCCc1ccc(cc1)C(=O)Oc1ccc(C#N)cc1 |
| Stereo: | ACHIRAL |
| logP: | 6.4592 |
| logD: | 6.4592 |
| logSw: | -5.6622 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 37.673 |
| InChI Key: | ZWAUTNYPKHVAEZ-UHFFFAOYSA-N |