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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 129878Generated: October 31, 2026

3,5-Bis(trifluoromethyl)phenyl isocyanate → 2-[2-[3-[3,5-Bis(trifluoromethyl)phenyl]ureido]-4-trifluoromethylphenoxy]-5-(1,1-dimethylpropyl)benzenesulfonic acid, ammonium salt

https://huagongshe.com/reaction/129878

Reaction equation

Participants

RoleNameHCIDCharge
Reactant3,5-Bis(trifluoromethyl)phenyl isocyanateHCID 2733314—
Reactant2-(2-Amino-4-trifluoromethylphenoxy)-5-(1,1-dimethylpropyl)benzenesulfonic acidHCID 9909132—
SolventPyridineHCID 1049—
Product2-[2-[3-[3,5-Bis(trifluoromethyl)phenyl]ureido]-4-trifluoromethylphenoxy]-5-(1,1-dimethylpropyl)benzenesulfonic acid, ammonium saltHCID 131719213—

Reaction Steps

2-(2-Amino-4-trifluoromethylphenoxy)-5-(1,1-dimethylpropyl)benzenesulfonic acid (260 mg, 0.0006 mol) and 3,5-bis(trifluoromethyl)phenyl isocyanate (130.9 ml, 0.0005 mol) were mixed in pyridine (5 ml), under argon, for sixteen hours at room temperature. The solvent was evaporated and the residue flash chromatographed (silica gel, methylene chloride/isopropanol/ammonium hydroxide), dried and evaporated to give the title compound. 1H NMR (250 MHz, DMSO) ∂9.20 (s, 1H), 8.90 (s, 1H), 7.90 (s, 1H), 7.50 (s, 2H), 7.25 (d, 1H), 7.05 (s, 1H), 6.80-6.30 (m, 4H), 1.0 (q, 3H), 0.065 (s, 6H), 0.045 (d, 2H).

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS05470882
Source datasetuspto-grants-1995_11
ORD IDord-d9f93a8a22684b8caca1c3ff7498a6a4
Source noteuspto-grants-1995_11