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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 2179503Generated: October 30, 2026

Methyl Benzoate → HCID 131733077, compound

https://huagongshe.com/reaction/2179503

Reaction equation

Participants

RoleNameHCIDCharge
ReactantMethyl BenzoateHCID 7150—
ReactantSodium hydrideHCID 24758—
ReactantHCID 53311905HCID 53311905—
SolventTolueneHCID 1140—
SolventAmmonium ChlorideHCID 25517—
ProductHCID 131733077HCID 131733077—

Reaction Steps

Under N2, the mixture of (S)-5-biphenyl-4-ylmethyl-1-pyrrolidin-1-ylmethylpyrrolidin-2-one (3a, R1=pyrrolidinylmethyl) (6.68 g, 20 mmol) and benzoic acid methyl ester (3.0 g, 22 mmol) in 20 mL toluene is heated to reflux, sodium hydride (55% in mineral oil, 1.14 g, 26 mmol) is added, and stirred overnight at reflux. The reaction mixture is diluted with 20 mL saturated aqueous ammonium chloride solution and stirred for 15 min, stop stirring, and remove the lower aqueous layer. the organic phase is concentrated to dryness, the residue was purified by column chromatography (ethyl acetate/heptane=1/1) to give (R/S)-3-Benzoyl-(R)-5-biphenyl-4-ylmethyl-1-pyrrolidin-1-ylmethyl-pyrrolidin-2-one (4a, R1=pyrrolidinylmethyl, R4=phenyl), the ratio of (3S,5R) and (3R,5R) is 60:40 as determined by HPLC. 1HNMR (400 MHz, CDCl3): 1.68 (m, 4H, 2×CH2CH2), 1.98 (m, 1H, 3-CHH), 2.23 (m, 1H, 3-CHH), 2.51 (m, 4H, 2×NCH2), 2.65 (dd, 1H, N—CHH), 3.15 (dd, 1H, N—CHH), 2.67 (d, 1H, 5-CHH), 2.92 (d, 1H, 5-CHH), 3.73 (m, 1H, 2-CH), 3.78 (m, 1H, 4-CH), 7.20-8.00 (14H, m, aromatic).

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS09067883B2
Source datasetuspto-grants-2015_06
ORD IDord-8a9837561bef48c2bb06b33555778878
Source noteuspto-grants-2015_06