3-(Pyridin-4-ylcarbamoyl)-acrylic acid
(E)-4-oxo-4-(pyridin-4-ylamino)but-2-enoic acid
Also Known As: 3-(Pyridin-4-ylcarbamoyl)-acrylic acid|(E)-4-Oxo-4-(4-pyridinylamino)-2-butenoic Acid|(E)-4-oxo-4-(pyridin-4-ylamino)but-2-enoic acid
CAS: 85649-72-5
| Molecular Formula | C9H8N2O3 |
|---|---|
| Molecular Weight | 192.0535 g/mol |
| LogP | 0.6609 |
| Topological Polar Surface Area | 79.29 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 192.0535 |
| Monoisotopic Mass | 192.0535 |
| Heavy Atoms | 14 |
| Complexity | 359.57962 |
Chemical Identifiers
| CAS Number | 85649-72-5 |
|---|---|
| SMILES | C1=CN=CC=C1NC(=O)/C=C/C(=O)O |
Product Overview
3-(Pyridin-4-ylcarbamoyl)-acrylic acid (CAS 85649-72-5), with molecular formula C9H8N2O3 and molecular weight 192.0535 g/mol. IUPAC: (E)-4-oxo-4-(pyridin-4-ylamino)but-2-enoic acid.
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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