2-[2-nitro-4-(trifluoromethyl)phenoxy]-1H-isoindole-1,3(2H)-dione
Chemical Structure Depiction of
2-[2-nitro-4-(trifluoromethyl)phenoxy]-1H-isoindole-1,3(2H)-dione
2-[2-nitro-4-(trifluoromethyl)phenoxy]-1H-isoindole-1,3(2H)-dione
Compound characteristics
Compound ID: | 3434-1256 |
Compound Name: | 2-[2-nitro-4-(trifluoromethyl)phenoxy]-1H-isoindole-1,3(2H)-dione |
Molecular Weight: | 352.22 |
Molecular Formula: | C15 H7 F3 N2 O5 |
Smiles: | c1ccc2C(N(C(c2c1)=O)Oc1ccc(cc1[N+]([O-])=O)C(F)(F)F)=O |
Stereo: | ACHIRAL |
logP: | 3.8472 |
logD: | 3.8472 |
logSw: | -4.3505 |
Hydrogen bond acceptors count: | 9 |
Polar surface area: | 71.93 |
InChI Key: | PSERICXLBFDXQC-UHFFFAOYSA-N |