AC1NA8G3
methyl 5-(2-cyano-3-pyridin-3-ylprop-2-enoyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate
Also Known As: Methyl 5-(2-cyano-3-pyridin-3-yl-prop-2-enoyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate|methyl 5-(2-cyano-3-pyridin-3-ylprop-2-enoyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate|1H-Pyrrole-3-carboxylic acid, 5-[2-cyano-1-oxo-3-(3-pyridinyl)-2-propenyl]-2,4-dimethyl-, methyl ester (9CI)
CAS: 315696-96-9
| Molecular Formula | C17H15N3O3 |
|---|---|
| Molecular Weight | 309.11133 g/mol |
| LogP | 2.60302 |
| Topological Polar Surface Area | 95.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 309.11133 |
| Monoisotopic Mass | 309.11133 |
| Heavy Atoms | 23 |
| Complexity | 826.7587 |
Chemical Identifiers
| CAS Number | 315696-96-9 |
|---|---|
| SMILES | CC1=C(NC(=C1C(=O)OC)C)C(=O)C(=CC2=CN=CC=C2)C#N |
Product Overview
AC1NA8G3 (CAS 315696-96-9), with molecular formula C17H15N3O3 and molecular weight 309.11133 g/mol. IUPAC: methyl 5-(2-cyano-3-pyridin-3-ylprop-2-enoyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate.
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 →
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