3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-1-benzopyran-7-yl 2,2-dimethylpropanoate
Chemical Structure Depiction of
3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-1-benzopyran-7-yl 2,2-dimethylpropanoate
3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-1-benzopyran-7-yl 2,2-dimethylpropanoate
Compound characteristics
| Compound ID: | 4491-1051 |
| Compound Name: | 3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-1-benzopyran-7-yl 2,2-dimethylpropanoate |
| Molecular Weight: | 436.38 |
| Molecular Formula: | C22 H19 F3 O6 |
| Smiles: | CC(C)(C)C(=O)Oc1ccc2C(C(=C(C(F)(F)F)Oc2c1)Oc1ccc(cc1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 5.263 |
| logD: | 5.263 |
| logSw: | -5.2651 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 55.808 |
| InChI Key: | RXCXZJMUIDSLLQ-UHFFFAOYSA-N |