methyl 3,3,3-trifluoro-2-hydroxy-2-(4-hydroxy-3-methyl-5-nitrophenyl)propanoate
Chemical Structure Depiction of
methyl 3,3,3-trifluoro-2-hydroxy-2-(4-hydroxy-3-methyl-5-nitrophenyl)propanoate
methyl 3,3,3-trifluoro-2-hydroxy-2-(4-hydroxy-3-methyl-5-nitrophenyl)propanoate
Compound characteristics
| Compound ID: | 8014-8848 |
| Compound Name: | methyl 3,3,3-trifluoro-2-hydroxy-2-(4-hydroxy-3-methyl-5-nitrophenyl)propanoate |
| Molecular Weight: | 309.2 |
| Molecular Formula: | C11 H10 F3 N O6 |
| Smiles: | Cc1cc(cc(c1O)[N+]([O-])=O)C(C(=O)OC)(C(F)(F)F)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.221 |
| logD: | 2.1655 |
| logSw: | -2.0456 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.04 |
| InChI Key: | WJLNJOXWYJRUDL-SNVBAGLBSA-N |