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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1356589Generated: October 31, 2026

Carbon tetrabromide → Methyl 3-bromomethyl-5-tert-butylbenzoate

https://huagongshe.com/reaction/1356589

Reaction equation

Participants

RoleNameHCIDCharge
ReactantCarbon tetrabromideHCID 11205—
ReactantTriphenylphosphineHCID 11776—
ReactantMethyl 3-tert-butyl-5-(hydroxymethyl)benzoateHCID 12144659—
SolventDichloromethaneHCID 6344—
ProductMethyl 3-bromomethyl-5-tert-butylbenzoateHCID 1214466099%

Reaction Steps

To a solution of methyl 3-tert-butyl-5-hydroxymethylbenzoate VII (9.50 g, 42.7 mmol) and carbon tetrabromide (17.25 g, 52.0 mmol) in dichloromethane (50 mL) was slowly added triphenylphosphine (13.6 g, 52.0 mmol) over the period of 20 minutes, and the mixture was stirred at room temperature for 25 minutes. The reaction mixture was concentrated under reduced pressure and the residue was suspended in ethyl acetate. The precipitate was removed by filtration and the filtrate was concentrated. The crude material was purified by a silica gel chromatography (hexanes/ethyl acetate, 4:1), and the product was re-crystallized form ethyl acetate/hexanes to afford methyl 3-bromomethyl-5-tert-butylbenzoate VIII (12.0 g, 42.1 mmol, 99%) as a white solid: 1H NMR (CDCl3) δ 1.45 (s, 9H), 3.7 (s, 3H), 4.4 (s, 2H), 7.6 (s, 1H), 7.8 (s, 1H), 8.0 (s, 1H); 13C NMR (CDCl3) δ 31.3 (3C), 33.2, 36.0, 52.3, 126.9, 127.5, 130.6, 130.7, 137.9, 152.4, 167.0.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS06586623B2
Source datasetuspto-grants-2003_07
ORD IDord-49e9fe19a2374a9482cea5e0b828350c
Source noteuspto-grants-2003_07