dimethyl 2,3-dicyano-2-(2-oxocycloheptyl)butanedioate
Chemical Structure Depiction of
dimethyl 2,3-dicyano-2-(2-oxocycloheptyl)butanedioate
dimethyl 2,3-dicyano-2-(2-oxocycloheptyl)butanedioate
Compound characteristics
| Compound ID: | 8020-6756 |
| Compound Name: | dimethyl 2,3-dicyano-2-(2-oxocycloheptyl)butanedioate |
| Molecular Weight: | 306.32 |
| Molecular Formula: | C15 H18 N2 O5 |
| Smiles: | COC(C(C#N)C(C#N)(C1CCCCCC1=O)C(=O)OC)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.3922 |
| logD: | 1.3733 |
| logSw: | -1.2777 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 90.47 |
| InChI Key: | YXDVCPLEVGUDPU-UHFFFAOYSA-N |