1,2,3,3,5,6-hexafluoro-4-methyl-6-nitrocyclohexa-1,4-diene
Chemical Structure Depiction of
1,2,3,3,5,6-hexafluoro-4-methyl-6-nitrocyclohexa-1,4-diene
1,2,3,3,5,6-hexafluoro-4-methyl-6-nitrocyclohexa-1,4-diene
Compound characteristics
| Compound ID: | 1525-0590 |
| Compound Name: | 1,2,3,3,5,6-hexafluoro-4-methyl-6-nitrocyclohexa-1,4-diene |
| Molecular Weight: | 247.09 |
| Molecular Formula: | C7 H3 F6 N O2 |
| Smiles: | CC1=C(C(C(=C(C1(F)F)F)F)([N+]([O-])=O)F)F |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9271 |
| logD: | 2.9271 |
| logSw: | -3.0339 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 32.206 |
| InChI Key: | JPJKECYAXOMDBG-SSDOTTSWSA-N |