2-[(1-Oxidopyridin-1-ium-2-yl)sulfonylmethyl]benzonitrile
2-[(1-oxidopyridin-1-ium-2-yl)sulfonylmethyl]benzonitrile
Also Known As: 2-[(1-oxidopyridin-1-ium-2-yl)sulfonylmethyl]benzonitrile|2-(1-Oxy-pyridine-2-sulfonylmethyl)-benzonitrile|Benzonitrile, 2-[[(1-oxido-2-pyridinyl)sulfonyl]methyl]-|2-[(1-Oxo-1lambda~5~-pyridine-2-sulfonyl)methyl]benzonitrile
CAS: 62381-79-7
| Molecular Formula | C13H10N2O3S |
|---|---|
| Molecular Weight | 274.0412 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 91.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 274.0412 |
| Monoisotopic Mass | 274.0412 |
| Heavy Atoms | 19 |
| Complexity | 448.0 |
Chemical Identifiers
| CAS Number | 62381-79-7 |
|---|---|
| SMILES | C1=CC=C(C(=C1)CS(=O)(=O)C2=CC=CC=[N+]2[O-])C#N |
| InChIKey | RNMPZXUOLKFXBT-UHFFFAOYSA-N |
Product Overview
2-[(1-Oxidopyridin-1-ium-2-yl)sulfonylmethyl]benzonitrile (CAS 62381-79-7), with molecular formula C13H10N2O3S and molecular weight 274.0412 g/mol. IUPAC: 2-[(1-oxidopyridin-1-ium-2-yl)sulfonylmethyl]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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2-[(1-Oxidopyridin-1-ium-2-yl)sulfonylmethyl]benzonitrile is a custom synthesis product. We offer services from milligram to kilogram scale.
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