Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | Hydrochloric Acid | HCID 313 | — |
| Reactant | Water | HCID 962 | — |
| Reactant | Ethyl 3-cyano-2,4,5-trifluorobenzoate | HCID 18417534 | — |
| Solvent | Acetic Acid | HCID 176 | — |
| Product | 195532-64-0 | HCID 18417533 | 97.4% |
Reaction Steps
Ethyl 3-cyano-2,4,5-trifluorobenzoate (3.35 g, 14.6 mmol) was suspended in glacial acetic acid (5 mL). Concentrated hydrochloric acid (10 mL) was added thereto, and the mixture was stirred at 100° C. for 4 hours. While cooling with ice, water (100 mL) was added to the reaction mixture. Subsequently, the resultant mixture was extracted with chloroform (100 mL×4), followed by drying with sodium sulfate anhydrate. After filtration, the filtrate was concentrated under reduced pressure. The residue was recrystallized from chloroform/n-hexane, to thereby yield the title compound as a white solid (2.86 g, 97%).
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| Patent number | US07723524B2 |
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| Source dataset | uspto-grants-2010_05 |
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| ORD ID | ord-a01bd094050540038e130aa515ca663f |
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| Source note | uspto-grants-2010_05 |
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