2-phenyl-2-(3,5,5-trimethyl-4H-pyrazol-1-yl)acetonitrile
2-phenyl-2-(3,5,5-trimethyl-4H-pyrazol-1-yl)acetonitrile
Also Known As: BAS 04396433|2-phenyl-2-(3,5,5-trimethyl-4H-pyrazol-1-yl)acetonitrile|phenyl(3,5,5-trimethyl-4,5-dihydro-1H-pyrazol-1-yl)acetonitrile|AE-848/06146031|SR-01000323005-1|Phenyl-(3,5,5-trimethyl-4,5-dihydro-pyrazol-1-yl)-acetonitrile|2-phenyl-2-(3,5,5-trimethyl-4,5-dihydro-1H-pyrazol-1-yl)acetonitrile
CAS: 89969-65-3
| Molecular Formula | C14H17N3 |
|---|---|
| Molecular Weight | 227.14224 g/mol |
| LogP | 3.11148 |
| Topological Polar Surface Area | 39.39 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 227.14224 |
| Monoisotopic Mass | 227.14224 |
| Heavy Atoms | 17 |
| Complexity | 467.99072 |
Chemical Identifiers
| CAS Number | 89969-65-3 |
|---|---|
| SMILES | CC1=NN(C(C1)(C)C)C(C#N)C2=CC=CC=C2 |
Product Overview
2-phenyl-2-(3,5,5-trimethyl-4H-pyrazol-1-yl)acetonitrile (CAS 89969-65-3), with molecular formula C14H17N3 and molecular weight 227.14224 g/mol. IUPAC: 2-phenyl-2-(3,5,5-trimethyl-4H-pyrazol-1-yl)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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