3-(4-Bromophenyl)-1,2,3,4-oxatriazol-3-ium-5-olate
3-(4-bromophenyl)oxatriazol-3-ium-5-olate
Also Known As: 3-(4-bromophenyl)oxatriazol-3-ium-5-olate|3-(4-bromophenyl)-1,2,3,4-oxatriazol-3-ium-5-olate|3-(4-bromophenyl)-1,2,3,4-oxatriazol-5-ol|3-(4-bromophenyl)-2H-oxatriazol-3-ium-5-one|A0172/0007743
CAS: 80862-31-3
| Molecular Formula | C7H4BrN3O2 |
|---|---|
| Molecular Weight | 240.94868 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 65.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 240.94868 |
| Monoisotopic Mass | 240.94868 |
| Heavy Atoms | 13 |
| Complexity | 175.0 |
Chemical Identifiers
| CAS Number | 80862-31-3 |
|---|---|
| SMILES | C1=CC(=CC=C1[N+]2=NOC(=N2)[O-])Br |
| InChIKey | HNKGNCIIXYRYKJ-UHFFFAOYSA-N |
Product Overview
3-(4-Bromophenyl)-1,2,3,4-oxatriazol-3-ium-5-olate (CAS 80862-31-3), with molecular formula C7H4BrN3O2 and molecular weight 240.94868 g/mol. IUPAC: 3-(4-bromophenyl)oxatriazol-3-ium-5-olate.
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 →
3-(4-Bromophenyl)-1,2,3,4-oxatriazol-3-ium-5-olate is a custom synthesis product. We offer services from milligram to kilogram scale.
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