5-phenyl-4H-1,2,4-triazole-3-carbaldehyde
3-phenyl-1H-1,2,4-triazole-5-carbaldehyde
Also Known As: s-Triazole-3-carboxaldehyde, 5-phenyl-|5-Phenyl-4H-1,2,4-triazole-3-carbaldehyde|3-phenyl-1H-1,2,4-triazole-5-carbaldehyde|5-Phenyl-1H-1,2,4-triazole-3-carbaldehyde|5-Phenyl-4H-1,2,4-triazole-3-carbaldehyde #|893-083-5
CAS: 26899-64-9
| Molecular Formula | C9H7N3O |
|---|---|
| Molecular Weight | 173.05891 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 58.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 173.05891 |
| Monoisotopic Mass | 173.05891 |
| Heavy Atoms | 13 |
| Complexity | 180.0 |
Chemical Identifiers
| CAS Number | 26899-64-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=NNC(=N2)C=O |
| InChIKey | KGONHESTSCTJLO-UHFFFAOYSA-N |
Product Overview
5-phenyl-4H-1,2,4-triazole-3-carbaldehyde (CAS 26899-64-9), with molecular formula C9H7N3O and molecular weight 173.05891 g/mol. IUPAC: 3-phenyl-1H-1,2,4-triazole-5-carbaldehyde.
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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