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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1915499Generated: October 30, 2026

Sodium Bromide → HCID 59410064, compound

https://huagongshe.com/reaction/1915499

Reaction equation

Participants

RoleNameHCIDCharge
ReactantSodium BromideHCID 253881—
ReactantHCID 59410067HCID 59410067—
SolventWaterHCID 962—
SolventAcetonitrileHCID 6342—
SolventEthyl AcetateHCID 8857—
ProductHCID 59410064HCID 5941006472.1%

Reaction Conditions

Temperature80 °C

Reaction Steps

NaBr (420 mg, 131 μL, 4.08 mmol) was added to a solution of (S)-(4,4-difluoro-1-(4-nitro-3-(trifluoromethyl)phenyl)pyrrolidin-2-yl)methyl methanesulfonate (330 mg, 0.82 mmol) in acetonitrile (2.0 mL) and heated at 80° C. for 16 h. The reaction mixture was diluted with ethyl acetate (10 mL) and water (5 mL). The organic layer was separated, dried over Na2SO4, filtered and concentrated in vacuo. The residue was purified by silica gel column chromatography (15-50% ethyl acetate/hexane) to obtain (S)-2-(bromomethyl)-4,4-difluoro-1-(4-nitro-3-(trifluoromethyl)phenyl)pyrrolidine (230 mg, 72%) as a yellow oil. 1H NMR (400 MHz, DMSO-d6) δ 8.14 (d, J=8.7 Hz, 1H), 7.09-7.07 (m, 2H), 4.76-4.71 (m, 1H), 4.16-3.99 (m, 2H), 3.74 (dd, J=10.6, 3.0 Hz, 1H), 3.60 (t, J=9.7 Hz, 1H), 2.94-2.80 (m, 1H), 2.66-2.55 (m, 1H).

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08614327B2
Source datasetuspto-grants-2013_12
ORD IDord-7766a39ba3d84782ab82ddf9b8e73e2b
Source noteuspto-grants-2013_12