HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 58031819, compound → HCID 56602328, compound
Participants
| Role | Name | HCID | Charge |
|---|---|---|---|
| Reactant | HCID 58031819 | HCID 58031819 | — |
| Solvent | 1,4-Dioxane | HCID 31275 | — |
| Product | HCID 56602328 | HCID 56602328 | 54.3% |
Reaction Steps
A solution of 171 mg of 2-(1-{4-[2-(4-bromo-2-chlorophenoxy)-2-methylpropionylamino]phenyl}but-2-ynyl)malonic acid in 5 ml of dioxane was boiled at 120° C. for 17 h. The reaction mixture was concentrated and separated by means of preparative HPLC (Merck Hibar Purospher Star RP-18e 10 μm 25×250 mm; A: H2O+0.05% TFA; B: ACN+0.05% TFA; flow rate: 50 ml/min; in 15 minutes 10% B→90% B). The product fractions were freeze-dried to obtain 85 mg (54%) of 3-{4-[2-(4-bromo-2-chlorophenoxy)-2-methylpropionylamino]phenyl}hex-4-ynoic acid. C22H21BrClNO4 (478.77), LCMS (ESI-pos): 478/480/482 (M+H+).
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
|---|---|
| Patent number | US08648038B2 |
| Source dataset | uspto-grants-2014_02 |
| ORD ID | ord-cdd9a7e994a24d54a3c9a170e33964f3 |
| Source note | uspto-grants-2014_02 |