4-nitro-N-(1,2,4-triazol-4-yl)benzamide
4-nitro-N-(1,2,4-triazol-4-yl)benzamide
Also Known As: 4-nitro-N-(1,2,4-triazol-4-yl)benzamide|4-nitro-N-(4H-1,2,4-triazol-4-yl)benzamide|4-Nitro-N-[1,2,4]triazol-4-yl-benzamide|BAS 00483125|AB00081074-01|AG-205/33150054|N1-(4H-1,2,4-triazol-4-yl)-4-nitrobenzamide|SR-01000633436-1|(4-nitrophenyl)-N-(1,2,4-triazol-4-yl)carboxamide|A1675/0071470
CAS: 62591-62-2
| Molecular Formula | C9H7N5O3 |
|---|---|
| Molecular Weight | 233.05489 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 106.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 233.05489 |
| Monoisotopic Mass | 233.05489 |
| Heavy Atoms | 17 |
| Complexity | 291.0 |
Chemical Identifiers
| CAS Number | 62591-62-2 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=O)NN2C=NN=C2)[N+](=O)[O-] |
| InChIKey | HDRXSSZOGQDSNM-UHFFFAOYSA-N |
Product Overview
4-nitro-N-(1,2,4-triazol-4-yl)benzamide (CAS 62591-62-2), with molecular formula C9H7N5O3 and molecular weight 233.05489 g/mol. IUPAC: 4-nitro-N-(1,2,4-triazol-4-yl)benzamide.
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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