HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1361634Generated: October 30, 2026
Sodium Carbonate → 2-(Methylthio)-4-(2-(4-nitrophenoxy)phenyl)pyrimidine
https://huagongshe.com/reaction/1361634
Participants
| Role | Name | HCID | Charge |
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| Reactant | Sodium Carbonate | HCID 10340 | — |
| Reactant | 4-Chloro-2-methylthiopyrimidine | HCID 97113 | — |
| Reactant | 4,4,5,5-Tetramethyl-2-(2-(4-nitrophenoxy)phenyl)-1,3,2-dioxaborolane | HCID 66731681 | — |
| Catalyst | Bis(cyclopenta-1,4-dien-1-yl(diphenyl)phosphane);dichloropalladium;iron(2+) | HCID 178418228 | — |
| Solvent | 1,4-Dioxane | HCID 31275 | — |
| Product | 2-(Methylthio)-4-(2-(4-nitrophenoxy)phenyl)pyrimidine | HCID 66970422 | — |
Reaction Steps
To a mixture of 4,4,5,5-tetramethyl-2-(2-(4-nitrophenoxy)phenyl)-1,3,2-dioxaborolane (0.936 g, 2.7 mmol), Pd(dppf)Cl2 (0.10 g, 0.14 mmol) in dioxane and Sodium carbonate (2.0 M in water, 2.7 ml, 5.5 mmol) was added 4-chloro-2-methylthiopyrimidine (0.38 ml, 3.3 mmol). The brown mixture was sealed and heated to 80 deg. C. overnight. In the morning the reaction was partitioned between EtOAc/1N NaOH. The aqueous layer was extracted once with EtOAc. The combined organics were dried over anhyd. Na2SO4, filtered, and concentrated to a brown oil. This material was treated with CH2Cl2 and purified by silica gel chromatography eluting with 0-25% EtOAc/hexane. The product-containing fractions were concentrated to afford 2-(methylthio)-4-(2-(4-nitrophenoxy)phenyl)pyrimidine as a clear oil. MS m/z=340 [M+1]+. Calc'd for C17H13N3O3: 339.37.
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| Patent number | US07880000B2 |
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| Source dataset | uspto-grants-2011_02 |
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| ORD ID | ord-849fad91c72f45809ebce09f2cbfd14c |
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| Source note | uspto-grants-2011_02 |
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