HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1254806Generated: October 26, 2026
Potassium Carbonate → 2-(3-Chloro-4-cyano-2-vinyl-phenylamino)-3-hydroxy-butyric acid
https://huagongshe.com/reaction/1254806
Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | Potassium Carbonate | HCID 11430 | — |
| Reactant | D-Threonine | HCID 69435 | — |
| Reactant | 3-(2-Bromo-ethyl)-2-chloro-4-fluoro-benzonitrile | HCID 67007019 | — |
| Solvent | Dimethyl Sulfoxide | HCID 679 | — |
| Product | 2-(3-Chloro-4-cyano-2-vinyl-phenylamino)-3-hydroxy-butyric acid | HCID 67006033 | 97.1% |
Reaction Steps
To a suspension of D-Threonine (0.299 g, 2.51 mmol) and K2CO3 (1.21 g, 8.72 mmol) in DMSO (24 mL) was added 3-(2-Bromo-ethyl)-2-chloro-4-fluoro-benzonitrile (572 mg, 2.18 mmol) at room temperature. The reaction mixture was heated to 85° C. and stirred for 18 h. The reaction mixture was allowed to cool to room temperature and quenched with H2O (20 mL) and extracted with EtOAc (3×60 mL). The aqueous layer was then acidified with solid citric acid and extracted with EtOAc (2×80 mL). The later organic extracts were combined, washed with H2O (3×30 mL), dried (Na2SO4), filtered and concentrated under reduced pressure to provided the title compound as a pale yellow solid (594 mg, 97%): 1H NMR (400 MHz, d6-acetone, δ in ppm) 7.48 (d, J=9 Hz, 1H), 6.74 (d, J=9 Hz, 1H), 6.63 (dd, J=12 and 18 Hz, 1H), 5.97 (d, J=9 Hz, 1H), 5.88 (dd, J=2 and 12 Hz, 1H), 5.78 (dd, J=2 and 18 Hz, 1H), 4.51-4.42 (m, 2H), 4.23-4.21 (m, 1H), and 1.24 (d, J=7 Hz, 3H).
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| Patent number | US08455525B2 |
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| Source dataset | uspto-grants-2013_06 |
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| ORD ID | ord-fd7ffd951b0045fca95e0f95b6c11f66 |
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| Source note | uspto-grants-2013_06 |
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