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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 657684Generated: October 30, 2026

Trifluoroacetic acid → Trifluoroacetic acid

https://huagongshe.com/reaction/657684

Reaction equation

Participants

RoleNameHCIDCharge
ReactantTrifluoroacetic acidHCID 6422—
ReactantTriethylamineHCID 8471—
ReactantBenzene, 1-chloro-3-isocyanato-HCID 17968—
ReactantHCID 25105969HCID 25105969—
SolventAcetonitrileHCID 6342—
ProductTrifluoroacetic acidHCID 642217.3%
ProductHCID 25106032HCID 25106032—

Reaction Steps

To a stirred solution of Example 1 (10 mg, 0.038 mmol) in 1.0 mL of CH3CN was added 3-chloro-phenyl isocyanate (6.4 mg, 0.046 mmol) and triethylamine (8 μL, 0.057 mmol). The resulting mixture was stirred for over night at room temperature. The resulting mixture was purified by reverse phase HPLC (C-18 column, eluting with a 5-100% CH3CN gradient in 0.1% trifluoroacetic acid) to the title compound as its trifluoroacetic acid salt (3.5 mg, 17.3% yield). MS (ESI) m/z 416, 418 (M+H)+.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08076344B2
Source datasetuspto-grants-2011_12
ORD IDord-6c31a3ee987a49778ddee354820c9dd8
Source noteuspto-grants-2011_12