methyl 2-(2-bromo-2-cyanoethyl)benzoate
Chemical Structure Depiction of
methyl 2-(2-bromo-2-cyanoethyl)benzoate
methyl 2-(2-bromo-2-cyanoethyl)benzoate
Compound characteristics
| Compound ID: | 8014-6291 |
| Compound Name: | methyl 2-(2-bromo-2-cyanoethyl)benzoate |
| Molecular Weight: | 268.11 |
| Molecular Formula: | C11 H10 Br N O2 |
| Smiles: | COC(c1ccccc1CC(C#N)[Br])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7855 |
| logD: | 2.7855 |
| logSw: | -3.1397 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 38.468 |
| InChI Key: | VBJPMPUDQTYKFJ-VIFPVBQESA-N |