3-chloro-4-[(2,6-dimethylmorpholin-4-yl)methyl]benzonitrile--hydrogen chloride (1/1)
Chemical Structure Depiction of
3-chloro-4-[(2,6-dimethylmorpholin-4-yl)methyl]benzonitrile--hydrogen chloride (1/1)
3-chloro-4-[(2,6-dimethylmorpholin-4-yl)methyl]benzonitrile--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 8011-6337 |
| Compound Name: | 3-chloro-4-[(2,6-dimethylmorpholin-4-yl)methyl]benzonitrile--hydrogen chloride (1/1) |
| Molecular Weight: | 301.21 |
| Molecular Formula: | C14 H17 Cl N2 O |
| Salt: | HCl |
| Smiles: | CC1CN(CC(C)O1)Cc1ccc(C#N)cc1[Cl] |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.291 |
| logD: | 2.2855 |
| logSw: | -3.2358 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 27.9596 |
| InChI Key: | OTOMIICXPNUNMN-UHFFFAOYSA-N |