methyl 5-(2-cyanophenoxy)-4-oxopentanoate
Chemical Structure Depiction of
methyl 5-(2-cyanophenoxy)-4-oxopentanoate
methyl 5-(2-cyanophenoxy)-4-oxopentanoate
Compound characteristics
| Compound ID: | 8007-4706 |
| Compound Name: | methyl 5-(2-cyanophenoxy)-4-oxopentanoate |
| Molecular Weight: | 247.25 |
| Molecular Formula: | C13 H13 N O4 |
| Smiles: | COC(CCC(COc1ccccc1C#N)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2531 |
| logD: | 1.2531 |
| logSw: | -2.0222 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 58.215 |
| InChI Key: | IEULKCAYTBBXJY-UHFFFAOYSA-N |