6-chloro-4-methyl-7-[4-nitro-2-(trifluoromethyl)phenoxy]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6-chloro-4-methyl-7-[4-nitro-2-(trifluoromethyl)phenoxy]-2H-1-benzopyran-2-one
6-chloro-4-methyl-7-[4-nitro-2-(trifluoromethyl)phenoxy]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y040-6934 |
| Compound Name: | 6-chloro-4-methyl-7-[4-nitro-2-(trifluoromethyl)phenoxy]-2H-1-benzopyran-2-one |
| Molecular Weight: | 399.71 |
| Molecular Formula: | C17 H9 Cl F3 N O5 |
| Smiles: | CC1=CC(=O)Oc2cc(c(cc12)[Cl])Oc1ccc(cc1C(F)(F)F)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.9451 |
| logD: | 4.9451 |
| logSw: | -5.1265 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.948 |
| InChI Key: | NDLHOYFCWSTYOT-UHFFFAOYSA-N |