1-[(2,2,3,3,4,4,5,5,6,6,7,7-dodecafluoroheptyl)oxy]-2,4-dinitrobenzene
Chemical Structure Depiction of
1-[(2,2,3,3,4,4,5,5,6,6,7,7-dodecafluoroheptyl)oxy]-2,4-dinitrobenzene
1-[(2,2,3,3,4,4,5,5,6,6,7,7-dodecafluoroheptyl)oxy]-2,4-dinitrobenzene
Compound characteristics
| Compound ID: | 1187-0274 |
| Compound Name: | 1-[(2,2,3,3,4,4,5,5,6,6,7,7-dodecafluoroheptyl)oxy]-2,4-dinitrobenzene |
| Molecular Weight: | 498.18 |
| Molecular Formula: | C13 H6 F12 N2 O5 |
| Smiles: | C(C(C(C(C(C(C(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)Oc1ccc(cc1[N+]([O-])=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 5.085 |
| logD: | 5.085 |
| logSw: | -5.3928 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 74.286 |
| InChI Key: | CINBCMXPOAFIGY-UHFFFAOYSA-N |