HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1754856Generated: October 28, 2026
Trifluoroacetic acid → HCID 117738858, compound
https://huagongshe.com/reaction/1754856
Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | Trifluoroacetic acid | HCID 6422 | — |
| Reactant | Triethylamine | HCID 8471 | — |
| Reactant | Benzoyl isothiocyanate | HCID 68284 | — |
| Reactant | Thiourea | HCID 2723790 | — |
| Reactant | HCID 117738639 | HCID 117738639 | — |
| Solvent | Dichloromethane | HCID 6344 | — |
| Product | HCID 117738858 | HCID 117738858 | 83% |
Reaction Steps
Scheme 2, step I, (deprotection and thiourea formation): A solution of tert-butyl N-[(3S,4S)-3-(5-acetamido-2-fluoro-phenyl)-4-fluoro-4-(hydroxymethyl)tetrahydrofuran-3-yl]carbamate (2.70 g, 6.99 mmol) in dichloromethane (40 mL) and trifluoroacetic acid (8.00 mL, 106 mmol) is stirred at ambient temperature for 150 minutes. The reaction is concentrated under reduced pressure and azeotroped with toluene. The residue is dissolved in tetrahydrofuran and treated with triethylamine (1.10 mL, 7.89 mmol) and benzoyl isothiocyanate (1.00 mL, 7.41 mmol). The reaction is stirred at ambient temperature for 16.5 hours and is then quenched with a solution of saturated sodium bicarbonate in water, extracted with ethyl acetate and dichloromethane consecutively. The organic layers are combined, dried over magnesium sulfate, filtered, and concentrated under reduced pressure to give a residue. The residue is purified by silica gel flash chromatography, eluting with methanol/dichloromethane (0:10) to methanol/dichloromethane (1:10) to give the title compound (2.60 g, 83%). ES/MS (m/e): 450 (M+1).
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| Patent number | US09169271B2 |
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| Source dataset | uspto-grants-2015_10 |
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| ORD ID | ord-81fe2e36dc5542419e1246141d603468 |
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| Source note | uspto-grants-2015_10 |
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