| Identification | Back Directory | [Name]
6-(1H-IMIDAZOL-1-YL)NICOTINIC ACID | [CAS]
216955-75-8 | [Synonyms]
6-(1H-Imidazol-1-yl) 6-IMIDAZOL-1-YL-NICOTINIC ACID 6-(1H-Imidazol-1-yl)nicotinicaci 6-(1H-IMIDAZOL-1-YL)NICOTINIC ACID 6-imidazol-1-ylpyridine-3-carboxylic acid 6-(1H-imidazol-1-yl)-3-Pyridine carboxylic acid 3-Pyridinecarboxylic acid, 6-(1H-imidazol-1-yl)- Pyridine,2,4-dichloro-, 1-oxide6-(1H-IMIDAZOL-1-YL)NICOTINIC ACID 6-(1H-Imidazol-1-yl)pyridine-3-carboxylic acid, 1-(5-Carboxypyridin-2-yl)-1H-imidazole | [Molecular Formula]
C9H7N3O2 | [MDL Number]
MFCD00140821 | [MOL File]
216955-75-8.mol | [Molecular Weight]
189.17 |
| Chemical Properties | Back Directory | [Melting point ]
>270° | [Boiling point ]
442.5±30.0 °C(Predicted) | [density ]
1.39±0.1 g/cm3(Predicted) | [storage temp. ]
2-8°C | [pka]
2.92±0.10(Predicted) | [Appearance]
White to off-white Solid |
| Hazard Information | Back Directory | [Synthesis]
General procedure for the synthesis of 6-(1H-imidazol-1-yl)nicotinic acid from 6-(1H-imidazol-1-yl)nicotinic acid methyl ester: In a round-bottomed flask, 6-(1H-imidazol-1-yl)nicotinic acid methyl ester (535 mg, 2.50 mmol), tetrahydrofuran (12 mL), sodium hydroxide (780 mg, 19.50 mmol), and methanol (10 mL) were added, and the reaction was conducted at 50°C for 3 h. The reaction was heated at 50°C for 3 h. Upon completion of the reaction, the reaction mixture was acidified with 1N hydrochloric acid and subsequently concentrated to dryness under reduced pressure. The resulting solid was suspended in a mixed solvent of methanol/dichloromethane, filtered and concentrated to give 6-(1H-imidazol-1-yl)nicotinic acid as a white solid (0.47 g, 68% yield).LCMS (m/z): 190.0 (M + 1). | [References]
[1] Patent: WO2014/168824, 2014, A1. Location in patent: Page/Page column 39; 40 [2] Patent: WO2011/94890, 2011, A1. Location in patent: Page/Page column 130 |
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