| Identification | Back Directory | [Name]
2,6-DIMETHYL-5-IODO-4(3H)-PYRIMIDONE | [CAS]
83410-37-1 | [Synonyms]
2,6-DIMETHYL-5-IODO-4(3H)-PYRIMIDONE 5-Iodo-2,6-diMethyl-1H-pyriMidin-4-one 5-iodo-2,6-dimethyl-4(3H)-Pyrimidinone 5-Iodo-2,6-dimethylpyrimidin-4(3h)-one 4(3H)-Pyrimidinone, 5-iodo-2,6-dimethyl- 5-iodo-2,6-dimethyl-4-pyrimidinol(SALTDATA: FREE) | [Molecular Formula]
C6H7IN2O | [MDL Number]
MFCD02081996 | [MOL File]
83410-37-1.mol | [Molecular Weight]
250.04 |
| Chemical Properties | Back Directory | [Melting point ]
196-199 °C | [Boiling point ]
254.9±43.0 °C(Predicted) | [density ]
2.03±0.1 g/cm3(Predicted) | [storage temp. ]
2-8°C(protect from light) | [pka]
8.33±0.50(Predicted) |
| Hazard Information | Back Directory | [Synthesis]
Step A: 2,6-Dimethylpyrimidin-4-ol (5.0 g, 40 mmol) was dissolved in aqueous sodium hydroxide solution (50 mL, 1 M, 50 mmol). Iodine (10.2 g, 40 mmol) was subsequently added to this solution. The reaction mixture was slowly warmed to 80 °C and stirred continuously for 2 hours. Upon completion of the reaction, the mixture was cooled to room temperature and the pH was adjusted with acetic acid to about 6. At this point, a precipitate appeared in the reaction mixture and the precipitate was collected by filtration. The resulting solid was washed with deionized water and dried to give the target product 5-iodo-2,6-dimethylpyrimidin-4-ol (6.51 g, 65% yield). Mass spectrometry analysis showed m/z 251.2 [M + H]+. | [References]
[1] Patent: US9617268, 2017, B2. Location in patent: Page/Page column 398 [2] Journal of Medicinal Chemistry, 1998, vol. 41, # 22, p. 4251 - 4260 [3] Tetrahedron, 2007, vol. 63, # 9, p. 1931 - 1936 [4] Patent: US5466692, 1995, A [5] Patent: US2012/95031, 2012, A1. Location in patent: Page/Page column 160 |
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