4-(1H-1,2,3-benzotriazol-1-yl)benzonitrile
4-(benzotriazol-1-yl)benzonitrile
Also Known As: 4-(benzotriazol-1-yl)benzonitrile|1-(4-Cyanophenyl)-1H-benzotriazole|Benzonitrile, 4-(1H-benzotriazol-1-yl)-|p-(1H-Benzotriazole-1-yl)benzonitrile|4-(1H-Benzotriazole-1-yl)benzonitrile|4-(1H-1,2,3-benzotriazol-1-yl)benzonitrile|SR-01000207978-1
CAS: 212780-92-2
| Molecular Formula | C13H8N4 |
|---|---|
| Molecular Weight | 220.07489 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 54.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 220.07489 |
| Monoisotopic Mass | 220.07489 |
| Heavy Atoms | 17 |
| Complexity | 313.0 |
Chemical Identifiers
| CAS Number | 212780-92-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=NN2C3=CC=C(C=C3)C#N |
| InChIKey | ZPMPCBBSLDFJLQ-UHFFFAOYSA-N |
Product Overview
4-(1H-1,2,3-benzotriazol-1-yl)benzonitrile (CAS 212780-92-2), with molecular formula C13H8N4 and molecular weight 220.07489 g/mol. IUPAC: 4-(benzotriazol-1-yl)benzonitrile.
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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