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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1189942Generated: November 2, 2026

Benzene, 1-bromo-3-nitro- → HCID 86641448, compound

https://huagongshe.com/reaction/1189942

Reaction equation

Participants

RoleNameHCIDCharge
ReactantBenzene, 1-bromo-3-nitro-HCID 11457—
Reactant2,2,2-trifluoro-N-(prop-2-yn-1-yl)acetamideHCID 11094805—
CatalystCopper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)HCID 24350—
CatalystHCID 178418397HCID 178418397—
SolventTriethylamineHCID 8471—
ProductHCID 86641448HCID 86641448—

Reaction Conditions

Temperature90 °C

Reaction Steps

2,2,2-Trifluoro-N-(prop-2-ynyl)acetamide (3.4 g, 22.2 mmol), 1-bromo-3-nitrobenzene (14) (3.0 g, 14.85 mmol), Pd(Ph3P)4 (0.85 g, 0.74 mmol) and CuI (0.14 g, 0.74 mmol) was added to triethylamine (30 mL) and the mixture was flushed with argon for 15 min. The reaction mixture was stirred at 90° C. for 16 h, cooled and diluted with ethyl acetate. The mixture was filtered through Celite and the filtrate was concentrated under reduced pressure. Purification by column chromatography (100-200 silica mesh, 15% to 20% EtOAc in hexane) gave 2,2,2-trifluoro-N-(3-(3-nitrophenyl)prop-2-ynyl)acetamide as a brown semi-solid. Yield (1.95 g, 48%); 1H NMR (400 MHz, DMSO-d6) δ 8.22 (s, 1H), 8.16 (d, J=8.0 Hz, 1H), 1.79 (d, J=7.6 Hz, 1H), 7.66 (t, J=8.0 Hz, 1H), 7.34 (s, 1H), 4.38 (s, 2H).

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08674137B2
Source datasetuspto-grants-2014_03
ORD IDord-8aec125056d249218464730eeede7c49
Source noteuspto-grants-2014_03