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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 452032Generated: October 26, 2026

Potassium Phosphate, Tribasic → Methyl 4-(3-amino-1,2,4-triazin-6-yl)-2-chlorobenzoate

https://huagongshe.com/reaction/452032

Reaction equation

Participants

RoleNameHCIDCharge
ReactantPotassium Phosphate, TribasicHCID 62657—
Reactant6-Bromo-1,2,4-triazin-3-amineHCID 15332564—
Reactant3-Chloro-4-(methoxycarbonyl)benzeneboronic acidHCID 23005335—
CatalystHCID 178418397HCID 178418397—
SolventWaterHCID 962—
Solvent1,4-DioxaneHCID 31275—
ProductMethyl 4-(3-amino-1,2,4-triazin-6-yl)-2-chlorobenzoateHCID 5751652455.7%

Reaction Conditions

Temperature82 °C

Reaction Steps

To a mixture of 6-bromo-1,2,4-triazin-3-amine (Step 1, 1.0 g, 5.7 mmol) and [3-chloro-4-(methoxycarbonyl)phenyl]boronic acid (1.5 g, 6.8 mmol) (VMR, Cat. #100013-404) in 1,4-dioxane (22 mL) was added a solution of potassium phosphate (2.4 g, 11 mmol) in water (5.1 mL). The mixture was degassed by purging nitrogen for 10 min. To the mixture was added tetrakis(triphenylphosphine)palladium(0) (0.20 g, 0.17 mmol) and again was degassed with nitrogen. The mixture was stirred and heated at 82° C. (an oil bath) for 1 h. The mixture was cooled to r.t., diluted with water, stirred for 30 min, and a grey solid formed. The solid was isolated by filtration, rinsed several times with water, and dried in air. The solid was then triturated sequentially with hexanes, dichloromethane-hexanes (1:1), and hexanes to afford the desired product (840 mg, 55.54%). LCMS (M+H)+: m/z=264.9/267.0.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08487096B2
Source datasetuspto-grants-2013_07
ORD IDord-89edc7b3b08c46acb48b7bfa97a9e51a
Source noteuspto-grants-2013_07