3-(3-methylphenoxy)-4-oxo-2-(trifluoromethyl)-4H-1-benzopyran-7-yl furan-2-carboxylate
Chemical Structure Depiction of
3-(3-methylphenoxy)-4-oxo-2-(trifluoromethyl)-4H-1-benzopyran-7-yl furan-2-carboxylate
3-(3-methylphenoxy)-4-oxo-2-(trifluoromethyl)-4H-1-benzopyran-7-yl furan-2-carboxylate
Compound characteristics
| Compound ID: | 4491-2341 |
| Compound Name: | 3-(3-methylphenoxy)-4-oxo-2-(trifluoromethyl)-4H-1-benzopyran-7-yl furan-2-carboxylate |
| Molecular Weight: | 430.34 |
| Molecular Formula: | C22 H13 F3 O6 |
| Smiles: | Cc1cccc(c1)OC1=C(C(F)(F)F)Oc2cc(ccc2C1=O)OC(c1ccco1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8082 |
| logD: | 4.8082 |
| logSw: | -4.7972 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 56.571 |
| InChI Key: | XIHOKUMYZTUWNI-UHFFFAOYSA-N |