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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 2093128Generated: November 1, 2026

Diiodomethane → 2-Iodo-5-(trifluoromethyl)benzonitrile

https://huagongshe.com/reaction/2093128

Reaction equation

Participants

RoleNameHCIDCharge
ReactantDiiodomethaneHCID 6346—
ReactantTert-Butyl nitriteHCID 10906—
Reactant4-Amino-3-cyanobenzotrifluorideHCID 12627361—
SolventDiethyl EtherHCID 3283—
SolventAcetonitrileHCID 6342—
Product2-Iodo-5-(trifluoromethyl)benzonitrileHCID 53363644—

Reaction Conditions

Temperature35 °C

Reaction Steps

To a solution of 2-amino-5-(trifluoromethyl)benzonitrile (Intermediate 7, 15.1 g) and diiodomethane (24 mL) in acetonitrile (150 mL) at 35° C. was added t-butyl nitrite (21 mL) dropwise. The reaction was maintained at approximately 35° C. during the addition. The reaction was aged for 30 min and then heated to 60° C. for 30 minutes. The reaction mixture was cooled, diluted with ether and washed twice with water, twice with aqueous sodium bisulfite, water and then brine. The solution was dried over anhydrous MgSO4, filtered through a silica gel plug and then concentrated giving afford a red oil. The product was purified by silica gel chromatography eluting sequentially with hexanes, 3:1 hexanes/CH2Cl2 and 1:1 hexanes/CH2Cl2 to afford 2-iodo-5-(trifluoromethyl)benzonitrile. 1H NMR (CDCl3, 500 MHz) δ 8.10 (d, J=8.5 Hz, 1H), 7.85 (d, J=1.8 Hz, 1H), 7.52 (dd, J=8.5, 1.8 Hz, 1H).

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08440702B2
Source datasetuspto-grants-2013_05
ORD IDord-e9ee8ec4a73346bcbab0d63d6a284382
Source noteuspto-grants-2013_05