4-Cyanophenylacetonitrile
4-(cyanomethyl)benzonitrile
Also Known As: 4-(Cyanomethyl)benzonitrile|4-Cyanophenylacetonitrile|Benzeneacetonitrile, 4-cyano-|p-Cyanobenzylcyanide|Benzeneacetonitrile|4-Cyanbenzylcyanide|4-cyanobenzeneacetonitrile|4-Cyanobenzylcyanide|p-Tolunitrile, .alpha.-cyano-|4-Cyanomethylbenzonitrile|alpha-Cyano-p-tolunitrile|alpha,4-Dicyanotoluene|.alpha.,4-Dicyanotoluene|.alpha.-Cyano-p-tolunitrile|ACMC-209qoz|p-cyanophenylacetonitrile|p-Tolunitrile, alpha-cyano-|3-bromo-2-methoxypyridine|(4-Cyanophenyl)acetonitrile|? 4-Cyanophenylacetonitrile|Benzeneacetonitrile,4-cyano-|4-(cyanomethyl) benzonitrile|4-(Cyanomethyl)benzonitrile #|4-Cyanophenylacetonitrile 97%|4-Cyanophenylacetonitrile, 97%|KS-00000KWK|4-CYANOPHENYLACETONITRILE97|KM2534|4-CYANOPHENYLACETONITRILE 97
| Molecular Formula | C1=CC(=CC=C1CC#N)C#N |
|---|---|
| Molecular Weight | 142.0531 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 47.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 142.0531 |
| Monoisotopic Mass | 142.0531 |
| Heavy Atoms | 11 |
| Complexity | 206.0 |
Chemical Identifiers
| CAS Number | 876-31-3 |
|---|---|
| SMILES | C1=CC(=CC=C1CC#N)C#N |
| InChIKey | QILKKAFYAFEWGU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Cyanophenylacetonitrile (CAS 876-31-3), with molecular formula C1=CC(=CC=C1CC#N)C#N and molecular weight 142.0531 g/mol. IUPAC: 4-(cyanomethyl)benzonitrile.