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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1879624Generated: October 31, 2026

Trifluoroacetic acid → HCID 46893526, compound

https://huagongshe.com/reaction/1879624

Reaction equation

Participants

RoleNameHCIDCharge
ReactantTrifluoroacetic acidHCID 6422—
ReactantHCID 71059042HCID 71059042—
SolventDichloromethaneHCID 6344—
ProductHCID 46893526HCID 46893526—

Reaction Steps

To a solution of the slower-eluting enantiomer of the product from Step B (4.6 mg, 0.0069 mmol) in DCM (1 mL) was added TFA (1 mL, 13 mmol), and the solution was stirred for 30 minutes at RT. The solution was concentrated, then the residue was purified by reverse phase HPLC eluting with acetonitrile/water+0.1% TFA. Following lyophilization, this afforded the enantiopure title compound as a white solid. 1H NMR (500 MHz, CD3OD): δ 7.92 (s, 1H); 7.62 (d, J=8.5 Hz, 2H); 7.53 (d, J=8.3 Hz, 2H); 7.43 (s, 1H); 7.36 (d, J=8.2 Hz, 2H); 7.33 (d, J=8.5 Hz, 2H); 4.78 (d, 3=11.5 Hz, 1H); 4.26 (s, 3H); 3.72 (td, J=11.4, 3.2 Hz, 1H); 3.52 (t, J=6.9 Hz, 2H); 2.55 (t, J=6.9 Hz, 2H); 1.68-1.57 (m, 1H); 1.50-1.43 (m, 1H); 1.05-0.97 (m, 2H); 0.73 (t, J=7.3 Hz, 3H); LC2 1.31 min. (M+H)+ 606.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08318667B2
Source datasetuspto-grants-2012_11
ORD IDord-4fe7a17432f24f7bb05b040ccd4aebf8
Source noteuspto-grants-2012_11