HuagongsheHuagongshe Chemistry Print Report · For research reference only
Boron tribromide → US10023592, Example 80
Participants
| Role | Name | HCID | Charge |
|---|---|---|---|
| Reactant | Boron tribromide | HCID 25134 | — |
| Reactant | 4-[5-(ethylsulfonyl)-2-methoxyphenyl]-2-methyl-6-(1-methyl-1H-pyrazol-4-yl)isoquinolin-1(2H)-one | HCID 118021476 | — |
| Solvent | Dichloromethane | HCID 6344 | — |
| Product | US10023592, Example 80 | HCID 118021404 | 36.1% |
Reaction Steps
At −78° C., a 4 M solution of BBr3 (2.3 mL, 9.2 mmol) in CH2Cl2 was added to the title compound of Example 79 (200.0 mg, 0.458 mmol) in dry CH2Cl2 (8 mL). The mixture was refluxed for 18 h. Extractive work up with CH2Cl2 and purification by silica gel chromatography (DCM:MeOH=100:1 to 20:1) gave the title compound (70 mg, 36.1%) as a brown solid. 1H NMR (CDCl3, 400 MHz) δ 8.39 (d, J=8.4 Hz, 1H), 7.99 (s, 1H), 7.87 (dd, J1=8.8 Hz, J2=2.4 Hz, 1H), 7.80 (s, 1H), 7.79 (s, 1H), 7.76 (d, J=1.6 Hz, 1H), 7.39 (s, 1H), 7.35 (d, J=1.2 Hz, 1H), 7.18 (d, J=8.8 Hz, 1H), 3.91 (s, 3H), 3.67 (s, 3H), 3.25 (q, J=7.6 Hz, 2H), 1.27 (t, J=7.6 Hz, 3H). LCMS: 424.0 (M+H)+
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
|---|---|
| Patent number | US09034900B2 |
| Source dataset | uspto-grants-2015_05 |
| ORD ID | ord-42abc83b6dd842228fcb9e7be68c6399 |
| Source note | uspto-grants-2015_05 |