HuagongsheHuagongshe Chemistry Print Report · For research reference only
4-Chlorophenyl Isocyanate → HCID 131735647, compound
Participants
| Role | Name | HCID | Charge |
|---|---|---|---|
| Reactant | 4-Chlorophenyl Isocyanate | HCID 7693 | — |
| Reactant | HCID 117870991 | HCID 117870991 | — |
| Catalyst | Dimethyl Sulfoxide | HCID 679 | — |
| Solvent | Acetonitrile | HCID 6342 | — |
| Product | HCID 131735647 | HCID 131735647 | 118.2% |
Reaction Steps
(2 S)-1,1,1-trifluoro-3-(2-(4-fluorophenyl)morpholino)propan-2-ol (39 mg, 133 μmol), TEA (92.7 μL, 665 μmol) and 1-chloro-4-isocyanatobenzene (20.4 mg, 133 μmol) were combined in 2 mL of acetonitrile and stirred at room temperature overnight. Several drops of DMSO were added to the mixture to make a clear solution. The solution was separated by reverse phase column chromatography (50-100% acetonitrile in water). The desired fractions were pooled, treated with 5 drops of conc. HCl and the solution lyophilized to afford the title compound (38 mg, 59%) as a white solid. (M+H)+=447 m/e.
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
|---|---|
| Patent number | US09353096B2 |
| Source dataset | uspto-grants-2016_05 |
| ORD ID | ord-836a1ef359f341bcb2033709b184366e |
| Source note | uspto-grants-2016_05 |