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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1882033Generated: October 31, 2026

Sodium Bicarbonate → HCID 59331263, compound

https://huagongshe.com/reaction/1882033

Reaction equation

Participants

RoleNameHCIDCharge
ReactantSodium BicarbonateHCID 516892—
ReactantAmmonium AcetateHCID 517165—
ReactantMethyl 6-formylpyridine-3-carboxylateHCID 586269—
Reactant4-[4-(cyclopropylsulfonyl)phenyl]-5-(tetrahydro-2H-pyran-4-yl)pent-1-en-3-oneHCID 59331258—
Catalyst3-Benzyl-5-(2-hydroxyethyl)-4-methylthiazolium chlorideHCID 2833352—
SolventAcetic AcidHCID 176—
SolventEthanolHCID 702—
SolventWaterHCID 962—
SolventTriethylamineHCID 8471—
ProductHCID 59331263HCID 5933126350.2%

Reaction Conditions

Temperature70 °C

Reaction Steps

To a solution of 4-[4-(cyclopropylsulfonyl)phenyl]-5-(tetrahydro-2H-pyran-4-yl)pent-1-en-3-one (2.47 g) in ethanol (35 mL) were added methyl 6-formylpyridine-3-carboxylate (1.29 g), 3-benzyl-5-(2-hydroxyethyl)-4-methyl-1,3-thiazol-3-ium chloride (191 mg) and triethylamine (0.397 mL), and the mixture was stirred at 70° C. for 2.5 hr. Water was added to the reaction mixture, and the mixture was extracted with ethyl acetate. The extract was washed successively with water and saturated brine, dried over anhydrous magnesium sulfate and concentrated under reduced pressure. The residue was purified by silica gel column chromatography (ethyl acetate:hexane=20:80-70:30, volume ratio) to give colorless crystals. To a solution of the obtained crystals in acetic acid (50 mL) was added ammonium acetate (3.41 g), and the mixture was stirred at 110° C. for 2 hr. The reaction mixture was neutralized with saturated aqueous sodium hydrogen carbonate solution, and extracted with ethyl acetate. The extract was washed successively with water and saturated brine, dried over anhydrous magnesium sulfate and concentrated under reduced pressure. The residue was purified by silica gel column chromatography (ethyl acetate:hexane=20:80-80:20, volume ratio), and recrystallized from hexane-ethyl acetate to give the title compound (1.76 g, yield 50%) as pale-yellow crystals. MS: 495 (MH+). melting point 150-152° C.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08318746B2
Source datasetuspto-grants-2012_11
ORD IDord-4014f5775e3b45fcb3a245653a181d77
Source noteuspto-grants-2012_11