5-tert-butyl-1-(4-nitrophenyl)-1H-1,2,3-triazole
5-tert-butyl-1-(4-nitrophenyl)triazole
Also Known As: 5-tert-butyl-1-(4-nitrophenyl)triazole|5-tert-butyl-1-(4-nitrophenyl)-1H-1,2,3-triazole|AB00124508-03|5-(tert-butyl)-1-(4-nitrophenyl)-1H-1,2,3-triazole|SR-01000399306-1|F1480-0039
CAS: 313372-79-1
| Molecular Formula | C12H14N4O2 |
|---|---|
| Molecular Weight | 246.11168 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 76.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 246.11168 |
| Monoisotopic Mass | 246.11168 |
| Heavy Atoms | 18 |
| Complexity | 302.0 |
Chemical Identifiers
| CAS Number | 313372-79-1 |
|---|---|
| SMILES | CC(C)(C)C1=CN=NN1C2=CC=C(C=C2)[N+](=O)[O-] |
| InChIKey | FRAYZPDBVGAIJE-UHFFFAOYSA-N |
Product Overview
5-tert-butyl-1-(4-nitrophenyl)-1H-1,2,3-triazole (CAS 313372-79-1), with molecular formula C12H14N4O2 and molecular weight 246.11168 g/mol. IUPAC: 5-tert-butyl-1-(4-nitrophenyl)triazole.
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.
View MSDS →
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