HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 906607Generated: October 29, 2026
Methyl 2-amino-4-(1,1-difluoroethyl)-5-iodobenzoate → 2-amino-4-(1,1-difluoro-ethyl)-5-(2-isopropyl-2H-pyrazol-3-yl)-benzoic acid methyl ester
https://huagongshe.com/reaction/906607
Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | Methyl 2-amino-4-(1,1-difluoroethyl)-5-iodobenzoate | HCID 59164486 | — |
| Reactant | 1-Isopropyl-5-tributylstannanyl-1H-pyrazole | HCID 59164521 | — |
| Catalyst | HCID 178418476 | HCID 178418476 | — |
| Solvent | 1,4-Dioxane | HCID 31275 | — |
| Product | 2-amino-4-(1,1-difluoro-ethyl)-5-(2-isopropyl-2H-pyrazol-3-yl)-benzoic acid methyl ester | HCID 59164530 | 18.4% |
Reaction Steps
To a solution of 2-amino-4-(1,1-difluoro-ethyl)-5-iodo-benzoic acid methyl ester (0.809 g, 2.37 mmol) in dioxane (10 mL) were added 1-isopropyl-5-tributylstannanyl-1H-pyrazole (1.14 g, 2.84 mmol) and Pd(PPh3)2Cl2 (170 mg, 0.237 mmol) and the resulting mixture was stirred at 90° C. for 72 h. The solvent was removed in vacuo to afford a dark oil. The crude product was purified by flash chromatography (silica gel, EtOAc/hexanes (0:10 to 3:7)) to give 2-amino-4-(1,1-difluoro-ethyl)-5-(2-isopropyl-2H-pyrazol-3-yl)-benzoic acid methyl ester (141 mg, 0.436 mmol, 18%) ES-MS: m/z 324 [M+H]+, rt 6.39 min.
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| Patent number | US08012988B2 |
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| Source dataset | uspto-grants-2011_09 |
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| ORD ID | ord-2a1dec7cd5fc4ac8a78157a81eb77835 |
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| Source note | uspto-grants-2011_09 |
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