4-cyanophenyl 4-(octyloxy)benzoate
Chemical Structure Depiction of
4-cyanophenyl 4-(octyloxy)benzoate
4-cyanophenyl 4-(octyloxy)benzoate
Compound characteristics
| Compound ID: | 0076-0008 |
| Compound Name: | 4-cyanophenyl 4-(octyloxy)benzoate |
| Molecular Weight: | 351.44 |
| Molecular Formula: | C22 H25 N O3 |
| Smiles: | CCCCCCCCOc1ccc(cc1)C(=O)Oc1ccc(C#N)cc1 |
| Stereo: | ACHIRAL |
| logP: | 6.4139 |
| logD: | 6.4139 |
| logSw: | -5.6907 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 45.09 |
| InChI Key: | MRJRPUGIYJNPIH-UHFFFAOYSA-N |