3-(3,5-dimethylphenoxy)-4-oxo-2-(trifluoromethyl)-4H-1-benzopyran-7-yl methyl carbonate
Chemical Structure Depiction of
3-(3,5-dimethylphenoxy)-4-oxo-2-(trifluoromethyl)-4H-1-benzopyran-7-yl methyl carbonate
3-(3,5-dimethylphenoxy)-4-oxo-2-(trifluoromethyl)-4H-1-benzopyran-7-yl methyl carbonate
Compound characteristics
| Compound ID: | 4491-0261 |
| Compound Name: | 3-(3,5-dimethylphenoxy)-4-oxo-2-(trifluoromethyl)-4H-1-benzopyran-7-yl methyl carbonate |
| Molecular Weight: | 408.33 |
| Molecular Formula: | C20 H15 F3 O6 |
| Smiles: | Cc1cc(C)cc(c1)OC1=C(C(F)(F)F)Oc2cc(ccc2C1=O)OC(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 4.155 |
| logD: | 4.155 |
| logSw: | -4.5114 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 56.8 |
| InChI Key: | WXOISQJELVBJNK-UHFFFAOYSA-N |