| Identification | Back Directory | [Name]
2,4,5-Triamino-6-chloropyrimidine | [CAS]
1194-78-1 | [Synonyms]
2,4,5-Triamino-6-chloropyrimid 2,4,5-Triamio-6-chloropyrimidine 2,4,5-Triamino-6-chloropyrimidine 6-Chloro-2,4,5-pyrimidinetriamine 6-ChloropyriMidine-2,4,5-triaMine 2,4,5-Pyrimidinetriamine, 6-chloro- 2,4,5-Triamino-6-hydroxypyrimidine dihydrochloride | [Molecular Formula]
C4H6ClN5 | [MDL Number]
MFCD11114448 | [MOL File]
1194-78-1.mol | [Molecular Weight]
159.58 |
| Hazard Information | Back Directory | [Synthesis]
General procedure for the synthesis of 2,4,5-triamino-6-chloropyrimidine from 2,5-diamino-4,6-dichloropyrimidine: 2,5-diamino-4,6-dichloropyrimidine (1 equiv.) was suspended in concentrated ammonia (18 mL/mmol), placed in a sealed reaction tube, and heated to 135 °C for 24 hours. Upon completion of the reaction, the reaction mixture was concentrated under vacuum and subsequently purified by silica gel column chromatography with the eluent being a solvent mixture of dichloromethane/methanol/concentrated ammonia to give the final target compound 2,4,5-triamino-6-chloropyrimidine (93% yield). The structure of the product was confirmed by 13C NMR (101 MHz, J6-DMSO) with the chemical shifts of δ 156.0, 155.5, 113.3, 39.5, respectively; the analytical results of high-resolution mass spectrometry (HRMS-ESI) were in accordance with the theoretical values, with the calculated value of C4H7ClN5 [M + H]+ 160.03845 and the measured value of 160.0385. | [References]
[1] Patent: WO2016/87665, 2016, A2. Location in patent: Page/Page column 102 |
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