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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 887217Generated: October 25, 2026

Hexane → 3-1H-indol-4-yl-1-{[4-(trifluoromethyl)phenyl]methyl}urea

https://huagongshe.com/reaction/887217

Reaction equation

Participants

RoleNameHCIDCharge
ReactantHexaneHCID 8058—
Reactant4-(Trifluoromethyl)benzylamineHCID 76804—
Reactant4-isocyanato-1H-indoleHCID 22032644—
SolventTetrahydrofuranHCID 8028—
Product3-1H-indol-4-yl-1-{[4-(trifluoromethyl)phenyl]methyl}ureaHCID 10314759—

Reaction Steps

The product of Example 80A (0.16 g, 1 mmol) in THF (3 mL) was treated with 4-(trifluoromethyl)benzylamine (0.19 g, 1.1 mmol) at ambient temperature. After stirring for 3 hours, hexane was added to the reaction mixture to precipitate the title compound as a solid. mp 178° C. 1H NMR (300 MHz, DMSO-d6) δ 4.43 (d, 2H), 6.53 (t, 1H), (6.98 m, 3H), 7.26 (t, 1H), 7.57 (d, 2H), 7.62 (d, 1H), 7.71 (d, 2H), 8.37 (s, 1H), 11.04 (s, 1H); MS (DCI+) m/z 334 (M+H); Anal. Calcd. For C17H14N3F3O: C, 61.26; H, 4.23; N, 12.61. Found: C, 61.28; H, 3.83; N, 12.31.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08247413B2
Source datasetuspto-grants-2012_08
ORD IDord-68849f8d447b4c25882eddfb058e6589
Source noteuspto-grants-2012_08