HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 713921Generated: October 29, 2026
Trifluoroacetic acid → HCID 178498774, compound
https://huagongshe.com/reaction/713921
Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | Trifluoroacetic acid | HCID 6422 | — |
| Reactant | N-Iodosuccinimide | HCID 120273 | — |
| Reactant | HCID 178498772 | HCID 178498772 | — |
| Solvent | Acetonitrile | HCID 6342 | — |
| Product | HCID 178498774 | HCID 178498774 | 56% |
Reaction Steps
Methyl 1-((6-((trans)-4-tert-butylcyclohexyloxy)naphthalen-2-yl)methyl)azetidine-3-carboxylate (410 mg, 1 mmol) and NIS (247 mg, 1.1 mmol, 2.0 eq.) were dissolved in CH3CN (5 mL). Then CF3COOH (35 mg, 0.3 mmol, 0.3 eq.) was added to the mixture dropwise at 0° C. The mixture was warmed to r.t. and stirred for another 1.5 h. Then the mixture was extracted with EtOAc and the organic layer was concentrated and purified by silica gel chromatography using PE/EA (1/1) as eluent to give product the title compound as a slight red solid (300 mg, 56%). ESI-MS (M+H+): 536.2. 1H NMR (400 MHz, CDCl3) δ: 8.19 (d, 1H), 7.93 (s, 1H), 7.81 (d, 1H), 7.62 (d, 1H), 7.22 (d, 1H), 4.34-4.28 (m, 4H), 3.91-3.67 (m, 1H), 3.80-3.78 (m, 3H), 3.75 (s, 3H), 2.24-2.21 (m, 2H), 1.90-1.88 (m, 2H), 1.62-1.58 (m, 2H), 1.15-1.12 (m, 3H), 0.89 (s, 9H).
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| Patent number | US09186367B2 |
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| Source dataset | uspto-grants-2015_11 |
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| ORD ID | ord-0bc87a8034a041ac9b0b9f9c18e9b035 |
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| Source note | uspto-grants-2015_11 |
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