3-(6-ethoxy-2H-1,3-benzodioxol-5-yl)-2-[4-(trifluoromethyl)phenyl]prop-2-enenitrile
Chemical Structure Depiction of
3-(6-ethoxy-2H-1,3-benzodioxol-5-yl)-2-[4-(trifluoromethyl)phenyl]prop-2-enenitrile
3-(6-ethoxy-2H-1,3-benzodioxol-5-yl)-2-[4-(trifluoromethyl)phenyl]prop-2-enenitrile
Compound characteristics
| Compound ID: | 5842-1132 |
| Compound Name: | 3-(6-ethoxy-2H-1,3-benzodioxol-5-yl)-2-[4-(trifluoromethyl)phenyl]prop-2-enenitrile |
| Molecular Weight: | 361.32 |
| Molecular Formula: | C19 H14 F3 N O3 |
| Smiles: | CCOc1cc2c(cc1/C=C(C#N)/c1ccc(cc1)C(F)(F)F)OCO2 |
| Stereo: | ACHIRAL |
| logP: | 4.8269 |
| logD: | 4.8269 |
| logSw: | -4.5587 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 41.349 |
| InChI Key: | CUZWAFWAUBVVCP-UHFFFAOYSA-N |