4-benzoyl-4-(2-cyanoethyl)heptanedinitrile
Chemical Structure Depiction of
4-benzoyl-4-(2-cyanoethyl)heptanedinitrile
4-benzoyl-4-(2-cyanoethyl)heptanedinitrile
Compound characteristics
| Compound ID: | 8006-0465 |
| Compound Name: | 4-benzoyl-4-(2-cyanoethyl)heptanedinitrile |
| Molecular Weight: | 279.34 |
| Molecular Formula: | C17 H17 N3 O |
| Smiles: | C(CC(CCC#N)(CCC#N)C(c1ccccc1)=O)C#N |
| Stereo: | ACHIRAL |
| logP: | 1.001 |
| logD: | 1.001 |
| logSw: | -1.6763 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 66.452 |
| InChI Key: | CJSOIFOTLJQHEY-UHFFFAOYSA-N |