4-((Morpholin-4-yl)methyl)benzonitrile
4-(morpholin-4-ylmethyl)benzonitrile
Also Known As: 4-(morpholinomethyl)benzonitrile|4-(morpholin-4-ylmethyl)benzonitrile|4- BENZONITRILE|USAF A-3730|4-[(morpholin-4-yl)methyl]benzonitrile|4-(4-morpholinylmethyl)benzonitrile|4-Morpholin-4-ylmethylbenzonitrile|N-(4-Cyanobenzyl)morpholine|Oprea1_422363|Oprea1_430604|alpha-(4-Morpholinyl)-p-tolunitrile|p-Tolunitrile, alpha-(4-morpholinyl)-|KS-00000NSU|Benzonitrile, 4-(4-morpholinylmethyl)-|4-(Morpholin-4-ylmethyl)-benzonitrile|Benzonitrile,4-(4-morpholinylmethyl)-|DS-2036|FS-3517|4-((Morpholin-4-yl)methyl)benzonitrile|4-(morpholin-4-ylmethyl)benzenecarbonitrile
| Molecular Formula | C12H14N2O |
|---|---|
| Molecular Weight | 202.11061 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 36.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 202.11061 |
| Monoisotopic Mass | 202.11061 |
| Heavy Atoms | 15 |
| Complexity | 231.0 |
Chemical Identifiers
| CAS Number | 4458-69-9 |
|---|---|
| SMILES | C1COCCN1CC2=CC=C(C=C2)C#N |
| InChIKey | BCZLYNFDOJXWGN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-((Morpholin-4-yl)methyl)benzonitrile (CAS 4458-69-9), with molecular formula C12H14N2O and molecular weight 202.11061 g/mol. IUPAC: 4-(morpholin-4-ylmethyl)benzonitrile.