HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 77780Generated: October 26, 2026
4-Methylmorpholine → 3-(2,2-Difluoro-propionylamino)-5-(5-methyl-pyridin-2-yl)-benzoic acid methyl ester
https://huagongshe.com/reaction/77780
Participants
| Role | Name | HCID | Charge |
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| Reactant | 4-Methylmorpholine | HCID 7972 | — |
| Reactant | 1-Ethyl-3-(3'-dimethylaminopropyl)carbodiimide | HCID 15908 | — |
| Reactant | 1-Hydroxybenzotriazole | HCID 75771 | — |
| Reactant | 2,2-Difluoropropionic acid | HCID 2782825 | — |
| Reactant | Methyl 3-amino-5-(5-methylpyridin-2-yl)benzoate | HCID 57851018 | — |
| Solvent | Acetonitrile | HCID 6342 | — |
| Product | 3-(2,2-Difluoro-propionylamino)-5-(5-methyl-pyridin-2-yl)-benzoic acid methyl ester | HCID 57851304 | 65.2% |
Reaction Steps
3-Amino-5-(5-methyl-pyridin-2-yl)-benzoic acid methyl ester (0.7 g, 2.89 mmol, from Preparation 2), 2,2-difluoropropionic acid (0.370 g, 2.89 mmol), EDCI (4.34 mmol), and HOBt (4.34 mmol) and NMM (14.45 mmol) were added to 25 mL of acetonitrile. The reaction mixture was stirred at room temperature for 21 hours, after which the acetonitrile was removed under reduced pressure. The residue was partitioned between water and EtOAc, and the combined organic layers were washed with water, dried (MgSO4), filtered and concentrated under reduced pressure. The residue was purified by flash chromatography (EtOAc/hexanes 35:1) to give 0.630 g of 3-(2,2-difluoro-propionylamino)-5-(5-methyl-pyridin-2-yl)-benzoic acid methyl ester as a white solid, MS (M+H)=335.
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| Patent number | US08841336B2 |
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| Source dataset | uspto-grants-2014_09 |
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| ORD ID | ord-69798100d43e4e48b61a72ef3fd95aa6 |
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| Source note | uspto-grants-2014_09 |
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