3-Methyl-4-phenylbenzonitrile
3-methyl-4-phenylbenzonitrile
Also Known As: 3-Methyl-4-phenylbenzonitrile|3-methyl-4-phenyl-benzonitrile|2-methyl-[1,1'-biphenyl]-4-carbonitrile|2-Methyl[1,1'-biphenyl]-4-carbonitrile|A1-96501
CAS: 5002-17-5
| Molecular Formula | C14H11N |
|---|---|
| Molecular Weight | 193.08914 g/mol |
| LogP | 3.5337 |
| Topological Polar Surface Area | 23.79 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 193.08914 |
| Monoisotopic Mass | 193.08914 |
| Heavy Atoms | 15 |
| Complexity | 506.60706 |
Chemical Identifiers
| CAS Number | 5002-17-5 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)C#N)C2=CC=CC=C2 |
Product Overview
3-Methyl-4-phenylbenzonitrile (CAS 5002-17-5), with molecular formula C14H11N and molecular weight 193.08914 g/mol. IUPAC: 3-methyl-4-phenylbenzonitrile.
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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