HuagongsheHuagongshe Chemistry Print Report · For research reference only
Acetic Acid → HCID 67455256, compound
Participants
| Role | Name | HCID | Charge |
|---|---|---|---|
| Reactant | Acetic Acid | HCID 176 | — |
| Reactant | Sodium Hydroxide | HCID 14798 | — |
| Reactant | Methyl 5-phenyl-4-(3,3,3-trifluoropropyl)isoxazole-3-carboxylate | HCID 67454167 | — |
| Solvent | Methanol | HCID 887 | — |
| Product | HCID 67455256 | HCID 67455256 | 20.9% |
Reaction Steps
A solution of methyl 5-phenyl-4-(3,3,3-trifluoropropyl)isoxazole-3-carboxylate (25 mg, 0.084 mmol) and 1N aqueous sodium hydroxide (125 μL, 0.125 mmol) in methanol (1 mL) was heated at 23° C. for 2 h. To the reaction mixture was added acetic acid until the pH was ˜5. The mixture was purified by preparative HPLC to afford 5-phenyl-4-(3,3,3-trifluoropropyl)isoxazole-3-carboxylic acid (5 mg). The compound had an HPLC ret. time=3.16 min.−Column. YMC S5 COMBISCREEN® 4.6×50 mm; Gradient time: 4 min; Flow rate=4 ml/min; Solvent A=10% MeOH−90% Water−0.2% H3PO4; Solvent B=90% MeOH−10% water−0.2% H3PO4; Start % B=0; Final % B=100. LC-MS: M+1=286+.
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
|---|---|
| Patent number | US08354398B2 |
| Source dataset | uspto-grants-2013_01 |
| ORD ID | ord-db32757a959b4465869be75c0e7dc0ac |
| Source note | uspto-grants-2013_01 |