HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1915486Generated: October 25, 2026
Triethylamine → (S)-2-methyl-1-(4-nitro-3-(trifluoromethyl)phenyl)pyrrolidine
https://huagongshe.com/reaction/1915486
Participants
| Role | Name | HCID | Charge |
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| Reactant | Triethylamine | HCID 8471 | — |
| Reactant | 5-Fluoro-2-nitrobenzotrifluoride | HCID 223094 | — |
| Reactant | (S)-2-Methylpyrrolidine 4-methylbenzenesulfonate | HCID 44118660 | — |
| Solvent | Acetonitrile | HCID 6342 | — |
| Product | (S)-2-methyl-1-(4-nitro-3-(trifluoromethyl)phenyl)pyrrolidine | HCID 59395009 | 94% |
Reaction Steps
To a solution of 5-fluoro-2-nitrobenzotrifluoride (2.0 g, 9.56 mmol) in CH3CN (20 mL) was added Et3N (2.41 g, 23.90 mmol) followed by the addition of (S)-2-methylpyrrolidine tosylate (3.18 g, 12.43 mmol). The reaction was stirred at 80° C. overnight. The reaction was then quenched with water and the aqueous layer was extracted with DCM. The combined organics were washed with 1N HCl, dried over MgSO4, filtered and concentrated to give (S)-2-methyl-1-(4-nitro-3-(trifluoromethyl)phenyl)pyrrolidine (2.45 g, 94% yield). 1H NMR (400 MHz, DMSO-d6) δ 8.11 (d, J=9.1 Hz, 1H), 6.88 (s, 1H), 6.85 (d, J=2.6 Hz, 1H), 4.17-4.13 (m, 1H), 3.59-3.54 (m, 1H), 3.33-3.28 (m, 1H), 2.14-2.00 (m, 3H), 1.80-1.71 (m, 1H), 1.14 (d, J=6.3 Hz, 3H). LC/MS: m/z 275.3 (M+H)+ at 1.98 min (10%-99% CH3CN (0.035% TFA)/H2O (0.05% TFA)).
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| Patent number | US08614327B2 |
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| Source dataset | uspto-grants-2013_12 |
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| ORD ID | ord-c0a107f0c648415eaecb5b127ad97eea |
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| Source note | uspto-grants-2013_12 |
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