HuagongsheHuagongshe Chemistry Print Report · For research reference only
Trifluoroacetic acid → HCID 66970398, compound
Participants
| Role | Name | HCID | Charge |
|---|---|---|---|
| Reactant | Trifluoroacetic acid | HCID 6422 | — |
| Reactant | 3-Amino-4-fluorobenzoic acid | HCID 75396 | — |
| Reactant | Triethylamine; trifluoroacetic acid | HCID 12210277 | — |
| Reactant | 4-(2-Chloropyridin-3-yl)pyrimidine | HCID 16108974 | — |
| Solvent | Isopropanol | HCID 3776 | — |
| Solvent | Triethylamine | HCID 8471 | — |
| Product | HCID 66970398 | HCID 66970398 | — |
Reaction Steps
4-(2-Chloro-pyridin-3-yl)-pyrimidine (240 mg, 1.2 mmol), 3-amino-4-fluorobenzoic acid (217 mg, 1.40 mmol), and 340 mg Et3N-TFA salt were mixed together in a sealed tube under argon. (The liquid Et3N-TFA reagent was generated by adding 2.5 mL TFA dropwise to a 0° C. solution of 3 mL Et3N in isopropanol, then concentrating by rotary evaporator followed by 30 minutes under high vacuum.). The mixture was melted at 95° C., and heating was continued overnight. The residue was triturated with a small amount of methanol and filtered to obtain the title compound as a solid. MS m/z=311 [M+H]+. Calc'd for C16H11FN4O2: 310.29.
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
|---|---|
| Patent number | US07880000B2 |
| Source dataset | uspto-grants-2011_02 |
| ORD ID | ord-dab026e1a574415eb425ed8f344139c1 |
| Source note | uspto-grants-2011_02 |