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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1424729Generated: October 25, 2026

Sodium → 4-[2-(4-Trifluoromethylphenyl)-pyrimidin-4-yl]-phenylamine

https://huagongshe.com/reaction/1424729

Reaction equation

Participants

RoleNameHCIDCharge
ReactantSodiumHCID 5360545—
Reactant4-(Trifluoromethyl)benzene-1-carboximidamide--hydrogen chloride--water (1/1/2)HCID 44630771—
Reactant4-(4-Nitrophenyl)-2-(4-trifluoromethylphenyl)-pyrimidineHCID 66968576—
SolventEthanolHCID 702—
SolventChloroform ethylacetateHCID 21584013—
Product4-[2-(4-Trifluoromethylphenyl)-pyrimidin-4-yl]-phenylamineHCID 6696888391%

Reaction Steps

4-(4-Nitrophenyl)-2-(4-trifluoromethylphenyl)-pyrimidine. To sodium metal (82.7 mg, 3.60 mmol) dissolved in absolute EtOH (3 mL) was added 4-trifluoromethylbenzamidine hydrochloride dihydrate (938 mg, 3.60 mmol) followed by EtOH (4 mL). After 30 min, 3-dimethylamino-1-(4-nitrophenyl)-propenone (498 mg, 2.26 mmol) was added, and the mixture was heated at reflux approximately 66 h and was then allowed to cool. The mixture was concentrated to a tan solid which was triturated under saturated sodium bicarbonate. The solid was collected and air dried to give 937 mg. It was then dissolved in chloroform/EtOAc and was passed over silica gel eluting with 7:3 chloroform/EtOAc to afford the title compound (710 mg, 91%): mp 175-176.5° C.; 1H NMR δ 9.01 (d, J=5.3 Hz, 1H), 8.73 (d, J=8.2 Hz, 2H), 8.43 (s, 4H), 7.82 (d, J=8.1 Hz, 2H), 7.76 (d, J=5.2 Hz, 1H); EIMS m/z 345 (M+, 100), 299 (57). Anal. Calcd. for C17H10F3N3O2: C, 59.13; H, 2.92; N, 12.17. Found: C, 58.82; H, 2.63; N, 11.98.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08927729B2
Source datasetuspto-grants-2015_01
ORD IDord-4b8143a9711943649596353fc30d4bd7
Source noteuspto-grants-2015_01