HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1805879Generated: October 26, 2026
2,6-Xylenol, 4-nitro- → 5-benzyl-2-chloro-4-(2,6-dimethyl-4-nitrophenoxy)-5H-pyrrolo[3,2-d]pyrimidine
https://huagongshe.com/reaction/1805879
Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | 2,6-Xylenol, 4-nitro- | HCID 17030 | — |
| Reactant | Sodium hydride | HCID 24758 | — |
| Reactant | 5-benzyl-2,4-dichloro-5H-pyrrolo[3,2-d]pyrimidine | HCID 14727765 | — |
| Solvent | Water | HCID 962 | — |
| Solvent | N-methyl-2-pyrrolidone | HCID 13387 | — |
| Product | 5-benzyl-2-chloro-4-(2,6-dimethyl-4-nitrophenoxy)-5H-pyrrolo[3,2-d]pyrimidine | HCID 57693568 | 94.4% |
Reaction Steps
To a stirred solution of NaH (61.9 mg, 2.6 mmol) in dry NMP (4.7 mL) was added 2,6-dimethyl-4-nitrophenol (258.9 mg, 1.55 mmol) and stirred at room temperature for 30 min under argon. The reaction mixture was added to a solution of 5-benzyl-2,4-dichloro-5H-pyrrolo[3,2-d]pyrimidine (431 mg, 1.55 mmol) in dry NMP (4 mL) and heated at 90° C. for 16 h. After completion of the reaction, the resulting mixture was diluted with water and washed with EtOAc. The combined organic layers were washed twice with water, washed with brine, dried over Na2SO4, filtered, and concentrated in vacuo. The crude product was purified by silica gel column chromatography, eluting with hexanes:ethyl acetate (3:1-1:1), to give the product as a white solid (598 mg, 94%).
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
|---|
| Patent number | US08354532B2 |
|---|
| Source dataset | uspto-grants-2013_01 |
|---|
| ORD ID | ord-cab69b3a6cb44a0292d48d270d2837cd |
|---|
| Source note | uspto-grants-2013_01 |
|---|