ammonium--2-cyano-3,5-bis(difluoromethyl)phenolate (1/1)
Chemical Structure Depiction of
ammonium--2-cyano-3,5-bis(difluoromethyl)phenolate (1/1)
ammonium--2-cyano-3,5-bis(difluoromethyl)phenolate (1/1)
Compound characteristics
| Compound ID: | Y502-5325 |
| Compound Name: | ammonium--2-cyano-3,5-bis(difluoromethyl)phenolate (1/1) |
| Molecular Weight: | 236.17 |
| Molecular Formula: | C9 H4 F4 N O |
| Salt: | NH4+ |
| Smiles: | C(c1c(cc(cc1[O-])C(F)F)C(F)F)#N |
| Stereo: | ACHIRAL |
| logP: | 1.8683 |
| logD: | 1.8683 |
| logSw: | -1.5997 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 33.843 |
| InChI Key: | OARMGJHLEVYKHX-UHFFFAOYSA-M |