7-[(3-methylphenyl)methoxy]-4-(trifluoromethyl)-2H-1-benzopyran-2-one
Chemical Structure Depiction of
7-[(3-methylphenyl)methoxy]-4-(trifluoromethyl)-2H-1-benzopyran-2-one
7-[(3-methylphenyl)methoxy]-4-(trifluoromethyl)-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y040-0038 |
| Compound Name: | 7-[(3-methylphenyl)methoxy]-4-(trifluoromethyl)-2H-1-benzopyran-2-one |
| Molecular Weight: | 334.29 |
| Molecular Formula: | C18 H13 F3 O3 |
| Smiles: | Cc1cccc(COc2ccc3C(=CC(=O)Oc3c2)C(F)(F)F)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.5001 |
| logD: | 4.5001 |
| logSw: | -4.6527 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 27.8733 |
| InChI Key: | XBJBDFDDLSBFRT-UHFFFAOYSA-N |