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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 2220870Generated: November 1, 2026

Acetonitrile → HCID 178506181, compound

https://huagongshe.com/reaction/2220870

Reaction equation

Participants

RoleNameHCIDCharge
ReactantAcetonitrileHCID 6342—
ReactantSodium HydroxideHCID 14798—
Reactant2-(Aminomethyl)anilineHCID 178096—
ReactantHCID 178503842HCID 178503842—
SolventDimethyl SulfoxideHCID 679—
SolventTrifluoroacetic acidHCID 6422—
ProductHCID 178506181HCID 17850618123%

Reaction Conditions

Temperature190 °C

Reaction Steps

Under an atmosphere of nitrogen, sodium hydroxide (0.1 ml, solution in water, 20 mol/l, 2 mmol) was added to a solution of 2-aminobenzylamine (92 mg, 0.75 mmol) in DMSO (1 ml). After 30 min, a solution of (3-trifluoromethyl-phenyl)-dimethyl-dithiocarbonimidate (200 mg, 0.75 mmol) in DMSO (1 ml) was added, and the mixture was heated to 190° C. for 3 h. The title compound (50 mg, 23%, MS: m/e=292.1 [M+H+]) was isolated from the reaction mixture by preparative, reverse phase HPLC (YMC CombiPrep C18 column 50×20 mm, solvent gradient 5-95% CH3CN in 0.1% TFA(aq) over 6.0 min, λ=230 nm, flow rate 40 ml/min).

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS07368454B2
Source datasetuspto-grants-2008_05
ORD IDord-efc3365becc74a879d7331c0b7137304
Source noteuspto-grants-2008_05