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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1772319Generated: November 3, 2026

Acetic Acid → HCID 67814058, compound

https://huagongshe.com/reaction/1772319

Reaction equation

Participants

RoleNameHCIDCharge
ReactantAcetic AcidHCID 176—
ReactantN-bromobutanimideHCID 67184—
ReactantHCID 67814333HCID 67814333—
SolventWaterHCID 962—
ProductHCID 67814058HCID 67814058—

Reaction Conditions

Temperature110 °C

Reaction Steps

To a resealable vial was added (3-methylisoxazol-5-yl)methyl benzoate (907 mg, 4.18 mmol), AcOH (3.5 ml, 61.1 mmol), and NBS (892 mg, 5.01 mmol). The reaction was heated to 110° C. overnight. The reaction was cooled to room temperature and diluted with water. The aqueous was extracted with EtOAc and the combined organics were washed with brine, dried over Na2SO4, filtered, and concentrated. The crude residue was purified via Biotage (EtOAc/hex) to afford (4-bromo-3-methylisoxazol-5-yl)methyl benzoate. m/z (ESI) 296, 298 [M+H]+.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS09249161B2
Source datasetuspto-grants-2016_02
ORD IDord-96ebc8aa40c44c22844ff5e827b4fd36
Source noteuspto-grants-2016_02