3-[4-nitro-2-(trifluoromethyl)phenoxy]-6H-dibenzo[b,d]pyran-6-one
Chemical Structure Depiction of
3-[4-nitro-2-(trifluoromethyl)phenoxy]-6H-dibenzo[b,d]pyran-6-one
3-[4-nitro-2-(trifluoromethyl)phenoxy]-6H-dibenzo[b,d]pyran-6-one
Compound characteristics
| Compound ID: | Y040-7667 |
| Compound Name: | 3-[4-nitro-2-(trifluoromethyl)phenoxy]-6H-dibenzo[b,d]pyran-6-one |
| Molecular Weight: | 401.3 |
| Molecular Formula: | C20 H10 F3 N O5 |
| Smiles: | c1ccc2c(c1)C(=O)Oc1cc(ccc12)Oc1ccc(cc1C(F)(F)F)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.684 |
| logD: | 4.684 |
| logSw: | -5.425 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 61.104 |
| InChI Key: | DKGVVXRTZOTAPX-UHFFFAOYSA-N |