2-(4-(Tert-pentyl)phenyl)acetonitrile
2-[4-(2-methylbutan-2-yl)phenyl]acetonitrile
Also Known As: 2-(4-(Tert-pentyl)phenyl)acetonitrile|2-[4-(2-methylbutan-2-yl)phenyl]acetonitrile|2-[4-(1,1-dimethylpropyl)phenyl]acetonitrile
CAS: 200725-68-4
| Molecular Formula | C13H17N |
|---|---|
| Molecular Weight | 187.1361 g/mol |
| LogP | 3.44028 |
| Topological Polar Surface Area | 23.79 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 187.1361 |
| Monoisotopic Mass | 187.1361 |
| Heavy Atoms | 14 |
| Complexity | 327.24835 |
Chemical Identifiers
| CAS Number | 200725-68-4 |
|---|---|
| SMILES | CCC(C)(C)C1=CC=C(C=C1)CC#N |
Product Overview
2-(4-(Tert-pentyl)phenyl)acetonitrile (CAS 200725-68-4), with molecular formula C13H17N and molecular weight 187.1361 g/mol. IUPAC: 2-[4-(2-methylbutan-2-yl)phenyl]acetonitrile.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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