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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1421595Generated: November 2, 2026

4-Chlorophenol → 6-Chloro-7-(4-chlorophenoxy)-2-(trifluoromethyl)-2H-1-benzopyran-3-carboxylic acid

https://huagongshe.com/reaction/1421595

Reaction equation

Participants

RoleNameHCIDCharge
Reactant4-ChlorophenolHCID 4684—
Reactantethyl 6-chloro-7-fluoro-2-(trifluoromethyl)-2H-chromene-3-carboxylateHCID 21883602—
Product6-Chloro-7-(4-chlorophenoxy)-2-(trifluoromethyl)-2H-1-benzopyran-3-carboxylic acidHCID 21883594—

Reaction Steps

The title compound was prepared from 4-chlorophenol and ethyl 6-chloro-7-fluoro-2-(trifluoromethyl)-2H-1-benzopyran-3-carboxylate (Example 183, Step 2) via a procedure similar to that described in Example 183, Steps 3 and 4: mp 205.4-206.5° C. 1H NMR (acetone-d6 /300 MHz) 7.93 (s, 1H), 7.75 (s, 1H), 7.50 (d, 2H, J=8.9 Hz), 7.19 (d, 2H, J=8.9 Hz), 6.69 (s, 1H), 5.87 (q, 1H, J=7.0 Hz). 19F NMR (acetone-d6 /282 MHz) -79.4 (d, J=7.2 Hz). FABLRMS m/z 403 (M-H). ESHRMS m/z 402.9773 (M-H, Calc'd 402.9752). Anal. Calc'd for C17H9Cl2F3O4 : C, 50.40; H, 2.24; Cl, 17.50. Found: C, 50.02; H, 1.98; Cl, 17.79.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS06077850
Source datasetuspto-grants-2000_06
ORD IDord-0b2d88eb01914c189ab842e8c80cb590
Source noteuspto-grants-2000_06