1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxylic acid
Chemical Structure Depiction of
1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxylic acid
1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxylic acid
Compound characteristics
| Compound ID: | 8010-9458 |
| Compound Name: | 1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-4-carboxylic acid |
| Molecular Weight: | 318.25 |
| Molecular Formula: | C13 H13 F3 N2 O4 |
| Smiles: | C1CN(CCC1C(O)=O)c1ccc(cc1[N+]([O-])=O)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 2.205 |
| logD: | -0.3481 |
| logSw: | -2.5558 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.879 |
| InChI Key: | XBGKHDVIWHAVTQ-UHFFFAOYSA-N |