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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1754302Generated: November 1, 2026

Water → Methyl 4-allyl-3-(4-benzyloxyazepan-1-yl)sulfonyl-benzoate

https://huagongshe.com/reaction/1754302

Reaction equation

Participants

RoleNameHCIDCharge
ReactantWaterHCID 962—
ReactantEthyl AcetateHCID 8857—
ReactantAllyltributylstannaneHCID 90628—
Reactantmethyl 3-(4-benzyloxyazepan-1-yl)Sulfonyl-4-bromo-benzoateHCID 118222070—
CatalystHCID 178418397HCID 178418397—
SolventTolueneHCID 1140—
ProductMethyl 4-allyl-3-(4-benzyloxyazepan-1-yl)sulfonyl-benzoateHCID 11822205952.8%

Reaction Conditions

Temperature110 °C

Reaction Steps

Methyl 3-(4-benzyloxyazepan-1-yl)sulfonyl-4-bromo-benzoate (1.30 g, 2.69 mmol, 1.00 Eq), allyl(tributyl)stannane (1.07 g, 3.23 mmol, 1.20 Eq) LiCl (136.83 mg, 3.23 mmol, 1.20 Eq) and Pd(PPh3)4 (310.85 mg, 269.00 umol, 0.10 Eq) in TOLUENE (20 mL) was de-gassed and then heated to 110° C. for 16 hr under N2. TLC (PE:EtOAc=1:1) showed the starting material and the product was the same spot. The reaction mixture was poured into H2O, extracted with EA. The organic phase was dried over anhydrous Na2SO4, concentrated in vacuum to give a residue, which was purified by column chromatography (silica gel, eluting with PE:EA=1:1) to afford the pure methyl 4-allyl-3-(4-benzyloxyazepan-1-yl)sulfonyl-benzoate (630.00 mg, 1.42 mmol, 52.80% yield) as light yellow solid.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS09169212B2
Source datasetuspto-grants-2015_10
ORD IDord-f54c1e5123de49fb95c43ec0f3999582
Source noteuspto-grants-2015_10