4-(methylsulfanyl)phenyl 4-heptylbenzoate
Chemical Structure Depiction of
4-(methylsulfanyl)phenyl 4-heptylbenzoate
4-(methylsulfanyl)phenyl 4-heptylbenzoate
Compound characteristics
| Compound ID: | 000L-0516 |
| Compound Name: | 4-(methylsulfanyl)phenyl 4-heptylbenzoate |
| Molecular Weight: | 342.5 |
| Molecular Formula: | C21 H26 O2 S |
| Smiles: | CCCCCCCc1ccc(cc1)C(=O)Oc1ccc(cc1)SC |
| Stereo: | ACHIRAL |
| logP: | 7.5241 |
| logD: | 7.5241 |
| logSw: | -5.7799 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 20.6162 |
| InChI Key: | WDVKVOWRWPQRRP-UHFFFAOYSA-N |