HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 2200646Generated: October 30, 2026
Trifluoroacetic acid → HCID 90402760, compound
https://huagongshe.com/reaction/2200646
Participants
| Role | Name | HCID | Charge |
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| Reactant | Trifluoroacetic acid | HCID 6422 | — |
| Reactant | HCID 90402960 | HCID 90402960 | — |
| Solvent | Dichloromethane | HCID 6344 | — |
| Product | HCID 90402760 | HCID 90402760 | 100.3% |
Reaction Steps
To a solution of tert-butyl 2-(7-(4-chlorobenzyl)-3-methyl-2,6-dioxo-8-(3-(trifluoromethoxy)phenoxy)-2,3,6,7-tetrahydro-1H-purin-1-yl)acetate (200 mg, 0.342 mmol) in DCM (5 ml) was added trifluoroacetic acid (2 ml, 26.9 mmol) at 0° C. The mixture was stirred at 0° C. to room temperature for 3 h. Then the mixture was concentrated, diluted with DCM and water. The phases were separated and the organic phase was washed with brine, dried over sodium sulfate, filtered and concentrated to give 2-(7-(4-chlorobenzyl)-3-methyl-2,6-dioxo-8-(3-(trifluoromethoxy)phenoxy)-2,3,6,7-tetrahydro-1H-purin-1-yl)acetic acid (180 mg, 99.9% yield) as white solid. 1H-NMR (DMSO-d6) δ 13.06(s, 1H), 7.64-7.59(t, 1H), 7.55(s, 1H), 7.48-7.43(m, 5H), 7.36-7.34(d, 1H), 5.43(s, 2H), 4.53(s, 2H), 3.37(s, 3H). LCMS retention time 2.994 min; LCMS MH+ 525.
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| Patent number | US09359359B2 |
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| Source dataset | uspto-grants-2016_06 |
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| ORD ID | ord-5f7b812ae13b472b8a87968ec68c9a33 |
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| Source note | uspto-grants-2016_06 |
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