methyl 3,3,3-trifluoro-2-hydroxy-2-(6-hydroxy-2H-1,3-benzodioxol-5-yl)propanoate
Chemical Structure Depiction of
methyl 3,3,3-trifluoro-2-hydroxy-2-(6-hydroxy-2H-1,3-benzodioxol-5-yl)propanoate
methyl 3,3,3-trifluoro-2-hydroxy-2-(6-hydroxy-2H-1,3-benzodioxol-5-yl)propanoate
Compound characteristics
| Compound ID: | 8013-2783 |
| Compound Name: | methyl 3,3,3-trifluoro-2-hydroxy-2-(6-hydroxy-2H-1,3-benzodioxol-5-yl)propanoate |
| Molecular Weight: | 294.18 |
| Molecular Formula: | C11 H9 F3 O6 |
| Smiles: | COC(C(c1cc2c(cc1O)OCO2)(C(F)(F)F)O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3277 |
| logD: | 2.3269 |
| logSw: | -2.1575 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.144 |
| InChI Key: | ZGBGMVOLVMKUPN-SNVBAGLBSA-N |