COUMARIN, 3-(3-PYRIDYL)-, N-OXIDE
3-(1-oxidopyridin-1-ium-3-yl)chromen-2-one
| Molecular Formula | C14H9NO3 |
|---|---|
| Molecular Weight | 239.23 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 51.8 A2 |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 239.05824 |
| Heavy Atoms | 18 |
| Complexity | 366.0 |
Chemical Identifiers
| CAS Number | 958-55-4 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=C(C(=O)O2)C3=C[N+](=CC=C3)[O-] |
| InChIKey | JQUCVNISFSPHEZ-UHFFFAOYSA-N |
📖 Product Overview
COUMARIN, 3-(3-PYRIDYL)-, N-OXIDE (CAS: 958-55-4) is a chemical compound with molecular formula C14H9NO3 and molecular weight 239.23 g/mol. Its IUPAC systematic name is 3-(1-oxidopyridin-1-ium-3-yl)chromen-2-one.
JQUCVNISFSPHEZ-UHFFFAOYSA-N.
SMILES: C1=CC=C2C(=C1)C=C(C(=O)O2)C3=C[N+](=CC=C3)[O-].
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