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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 2401333Generated: November 2, 2026

Acetic Acid → HCID 67814058, compound

https://huagongshe.com/reaction/2401333

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. LC/MS m/z 296 [M+H]+.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08796261B2
Source datasetuspto-grants-2014_08
ORD IDord-4e9eef0047fc45878dfe1f867c203117
Source noteuspto-grants-2014_08