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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1866458Generated: November 1, 2026

Sodium Carbonate → HCID 68977110, compound

https://huagongshe.com/reaction/1866458

Reaction equation

Participants

RoleNameHCIDCharge
ReactantSodium CarbonateHCID 10340—
Reactant1-(4-bromophenyl)-3-methyl-4,5-dihydro-1H-pyrazol-5-oneHCID 1201017—
ReactantHCID 68979582HCID 68979582—
CatalystHCID 178418397HCID 178418397—
Solvent1,2-DimethoxyethaneHCID 8071—
ProductHCID 68977110HCID 68977110101.1%

Reaction Steps

2-(4-Bromo-phenyl)-5-methyl-2,4-dihydro-pyrazol-3-one (105 mg) was dissolved in DME (ethylene glycol dimethyl ether, 2 mL), then Pd(PPh3)4 (15 mg, 3% mol) was added. The air was exchanged with argon and the mixture was stirred for 10 min. A solution of 2-(3-methoxy-4-methoxymethoxy-phenyl)-vinyl-boronic acid (90 mg) in DME (1 mL) was added followed by sodium carbonate solution (2M, 0.75 mL). The mixture was stirred for 1 hour at 110° C. After partitioning with ethyl acetate and water and purification over silica gel eluting with 50% EtOAc in hexane gave 140 mg of 2-{4-[2-(3-methoxy-4-methoxymethoxy-phenyl)-vinyl]-phenyl}-5-methyl-2,4-dihydro-pyrazol-3-one as an oily product, which was then hydrolyzed with conc. HCl in methanol. Evaporation of the solvent and purification over silica gel gave 2-{4-[2-(4-hydroxy-3-methoxy-phenyl)-vinyl]-phenyl}-5-methyl-2,4-dihydro -pyrazol-3-one as a light yellow solid (90 mg). 1HNMR (CDCl3, 300 MHz): 7.74 (d, J=8.6 Hz, 2H), 7.30 (d, J=8.6 Hz, 2H), 6.77 (s, 3H), 6.48 (s 2H), 5.66 (s, 1H), 3.63 (s, 3H), 3.42 (s, 2H), 2.19(s, 3H) ppm. 13CNMR (CDCl3—CD3OD, 75 MHz): 170.48, 156.45, 146.04, 144.89, 136.70, 134.28, 129.97, 129.41, 128.00, 122.47, 118.46, 114.21, 111.14, 55.72, 43.10, 17.05 ppm. MS (m/z): 323 (MH+).

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS07629375B2
Source datasetuspto-grants-2009_12
ORD IDord-a395f41843d747078ac1e5c1247504ac
Source noteuspto-grants-2009_12