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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1425274Generated: November 2, 2026

Water → methyl 2-chloro-1H-1,3-benzodiazole-7-carboxylate

https://huagongshe.com/reaction/1425274

Reaction equation

Participants

RoleNameHCIDCharge
ReactantWaterHCID 962—
ReactantPhosphorus oxychlorideHCID 24813—
ReactantSodium BicarbonateHCID 516892—
ReactantMethyl 2-oxo-2,3-dihydro-1H-benzo[d]imidazole-4-carboxylateHCID 22745204—
SolventTetrahydrofuranHCID 8028—
SolventEthyl AcetateHCID 8857—
Productmethyl 2-chloro-1H-1,3-benzodiazole-7-carboxylateHCID 6840747670.9%

Reaction Conditions

Temperature85 °C

Reaction Steps

Phosphorus oxychloride (8.5 g, 55.6 mmol) was added to methyl 2-oxo-2,3-dihydro-1H-benzimidazole-4-carboxylate (1.03 g, 5.36 mmol) (reference: WO 2006/116412 A2), and the mixture was stirred at 85° C. for four hours. The reaction solution was diluted with ethyl acetate and THF, slowly added to cold water and neutralized with sodium bicarbonate. The separated organic layer was washed with brine and dried over anhydrous sodium sulfate. Following concentration under reduced pressure, the residue was dissolved in toluene and the insoluble matter was removed. Concentration under reduced pressure gave 800 mg of the title compound as an oily substance. The resulting compound was used for the next reaction without purification.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08927588B2
Source datasetuspto-grants-2015_01
ORD IDord-56aab8db4c33494eb6e027593ce74b22
Source noteuspto-grants-2015_01