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HRID 251362作成日:2026年10月27日

Triethylamine → 5-Amino-1-(5-carboxy-2-methyl-phenyl)-3-methyl-1H-pyrazole-4-carboxylic acid ethyl ester

https://huagongshe.com/reaction/251362

反応式

関与物質

役割名称HCID仕込み量
反応物TriethylamineHCID 8471—
反応物Ethyl 2-cyano-3-ethoxy-2-butenoateHCID 46635—
反応物3-Hydrazino-4-methylbenzoic acid hydrochlorideHCID 56777508—
溶媒EthanolHCID 702—
生成物5-Amino-1-(5-carboxy-2-methyl-phenyl)-3-methyl-1H-pyrazole-4-carboxylic acid ethyl esterHCID 6702423687.9%

反応条件

温度65 °C

反応手順

To a stirred solution of 3-hydrazino-4-methylbenzoic acid hydrochloride (Example 3A, 353 mg, 1.74 mmol, 1.0 eq) in 15 mL of ethanol were added 2-cyano-3-ethoxy-but-2-enoic acid ethyl ester (prepared as described by Xia et al., J. Med. Chem., 1997, 40, 4372) (319 mg, 1.746 mmol, 1.0 eq) and triethylamine (242 μL, 1.74 mmol, 1.0 eq) and the mixture was heated at 65° C. overnight. The mixture was cooled to room temperature and concentrated. The crude residue was purified by flash chromatography on silica gel (loaded with CH2Cl2, and packed and eluted with gradient from 6/4 hexanes/EtOAc to elute byproducts followed by 8/2 EtOAc/hexanes and 8/2 EtOAc/MeOH to elute product) to provide the product as a brown solid (464 mg, 68%). HPLC (4 minute 10-95 gradient) tR 1.97 min; MS m/z 304.1 [M+H]+

情報源と証拠

DOI10.6084/m9.figshare.5104873.v1
特許番号US07863314B2
出典データセットuspto-grants-2011_01
ORD IDord-350dac818c464c3aab80db5292781355
出典メモuspto-grants-2011_01