methyl 3-(cyanomethyl)benzoate
Chemical Structure Depiction of
methyl 3-(cyanomethyl)benzoate
methyl 3-(cyanomethyl)benzoate
Compound characteristics
| Compound ID: | 8020-4826 |
| Compound Name: | methyl 3-(cyanomethyl)benzoate |
| Molecular Weight: | 175.18 |
| Molecular Formula: | C10 H9 N O2 |
| Smiles: | COC(c1cccc(CC#N)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6528 |
| logD: | 1.6528 |
| logSw: | -1.7174 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 38.904 |
| InChI Key: | XSNUGLQVCGENEM-UHFFFAOYSA-N |