3-(4-chlorophenyl)-4-oxo-2-(trifluoromethyl)-4H-1-benzopyran-7-yl methyl carbonate
Chemical Structure Depiction of
3-(4-chlorophenyl)-4-oxo-2-(trifluoromethyl)-4H-1-benzopyran-7-yl methyl carbonate
3-(4-chlorophenyl)-4-oxo-2-(trifluoromethyl)-4H-1-benzopyran-7-yl methyl carbonate
Compound characteristics
| Compound ID: | 5596-0484 |
| Compound Name: | 3-(4-chlorophenyl)-4-oxo-2-(trifluoromethyl)-4H-1-benzopyran-7-yl methyl carbonate |
| Molecular Weight: | 398.72 |
| Molecular Formula: | C18 H10 Cl F3 O5 |
| Smiles: | COC(=O)Oc1ccc2C(C(=C(C(F)(F)F)Oc2c1)c1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.9269 |
| logD: | 3.9269 |
| logSw: | -4.4635 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.463 |
| InChI Key: | DNVZRFNWXPZNBU-UHFFFAOYSA-N |