ethyl 3,3,3-trifluoro-2-hydroxy-2-(nitromethyl)propanoate
Chemical Structure Depiction of
ethyl 3,3,3-trifluoro-2-hydroxy-2-(nitromethyl)propanoate
ethyl 3,3,3-trifluoro-2-hydroxy-2-(nitromethyl)propanoate
Compound characteristics
| Compound ID: | 5712-0045 |
| Compound Name: | ethyl 3,3,3-trifluoro-2-hydroxy-2-(nitromethyl)propanoate |
| Molecular Weight: | 231.12 |
| Molecular Formula: | C6 H8 F3 N O5 |
| Smiles: | CCOC(C(C[N+]([O-])=O)(C(F)(F)F)O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.3778 |
| logD: | 0.3741 |
| logSw: | -0.2778 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.447 |
| InChI Key: | UPKDEANUYNBQSM-RXMQYKEDSA-N |