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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 504174Generated: October 29, 2026

Aniline → Methyl 4-amino-3-fluoro-5-nitro-2-(phenylamino)benzoate

https://huagongshe.com/reaction/504174

Reaction equation

Participants

RoleNameHCIDCharge
ReactantAnilineHCID 6115—
ReactantBenzoic acid, 4-amino-2,3-difluoro-5-nitro-, methyl esterHCID 2759749—
ProductMethyl 4-amino-3-fluoro-5-nitro-2-(phenylamino)benzoateHCID 44122658—

Reaction Conditions

Temperature125 °C

Reaction Steps

4-Amino-2,3-difluoro-5-nitro-benzoic acid methyl ester 4 (23.48 g, 101.1 mmol), the product of Example 1, Step C, is suspended in xylenes (125 mL) and aniline (92 mL, 1011 mmol) is added. The reaction mixture is stirred at 125° C. for 16 hours under N2. The reaction mixture is cooled to room temperature and solids precipitate out of solution. The solids are collected by filtration and are washed with xylenes and then diethyl ether. Recovered 22.22 g (72.78 mmol) of yellow solid which is pure desired product. The filtrate is concentrated under reduced pressure, redissolved in methylene chloride and flushed through a plug of silica gel eluting with methylene chloride. The desired fractions are concentrated under reduced pressure to give a brown solid which is triturated with diethyl ether to give 5.47 g (17.91 mmol) of yellow solid which is pure desired product. Combined product yield is 27.69 g (90%). MS APCI (−) m/z 304 (M−1) detected.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS07777050B2
Source datasetuspto-grants-2010_08
ORD IDord-f930cb9c56a4479c94ded40279f25085
Source noteuspto-grants-2010_08