Identification | Back Directory | [Name]
2-DIMETHYLAMINO-PYRIMIDINE-5-CARBALDEHYDE | [CAS]
55551-49-0 | [Synonyms]
ASISCHEM C63425 CHEMBRDG-BB 4010270 TIMTEC-BB SBB010324 2-DIMETHYLAMINO-PYRIMIDINE-5-CARBALDEHYDE 5-Pyrimidinecarboxaldehyde, 2-(dimethylamino)- 2-(N,N-DiMethylaMino)pyriMidine-5-carboxaldehyde 2-(dimethylamino)pyrimidine-5-carbaldehyde(SALTDATA: FREE) 2-DIMETHYLAMINO-PYRIMIDINE-5-CARBALDEHYDE ISO 9001:2015 REACH | [Molecular Formula]
C7H9N3O | [MDL Number]
MFCD03446733 | [MOL File]
55551-49-0.mol | [Molecular Weight]
151.17 |
Chemical Properties | Back Directory | [Melting point ]
122-124 °C | [Boiling point ]
289.6±32.0 °C(Predicted) | [density ]
1.204±0.06 g/cm3(Predicted) | [storage temp. ]
Inert atmosphere,2-8°C | [form ]
solid | [pka]
2.27±0.10(Predicted) | [Appearance]
White to off-white Solid | [InChI]
InChI=1S/C7H9N3O/c1-10(2)7-8-3-6(5-11)4-9-7/h3-5H,1-2H3 | [InChIKey]
XBYXYDVSCMMJDT-UHFFFAOYSA-N | [SMILES]
C1(N(C)C)=NC=C(C=O)C=N1 |
Hazard Information | Back Directory | [Synthesis]
General procedure for the synthesis of 2-dimethylaminopyrimidine-5-carbaldehyde from 2-chloropyrimidine-5-carbaldehyde: 2-chloropyrimidine-5-carbaldehyde (412 mg, 2.89 mmol) and triethylamine (Et3N, 482 μL, 3.47 mmol) were dissolved in dioxane (20 mL), followed by the addition of a solution of dimethylamine (Me2NH) in tetrahydrofuran (THF) (1.59 mL, 2.0 M, 3.18 mmol). The reaction mixture was stirred at room temperature for 1 h. After completion of the reaction, the reaction solution was filtered and the solid was washed with dioxane (5 mL). The filtrate was concentrated under vacuum to give 2-dimethylaminopyrimidine-5-carbaldehyde (427 mg, 97.7% yield) as a yellow solid. The product was analyzed by LC-MS (ES+) and showed a molecular ion peak [MH]+ of 152.2. HPLC analysis showed a retention time (Rt) of 4.14 min and a purity of 97.9%. | [References]
[1] Patent: US2015/258101, 2015, A1 |
|
Company Name: |
AAB-PHARMA LIMITED Gold
|
Tel: |
025-66800956 18800000000 |
Website: |
http://www.njdmchem.com/ |
Company Name: |
Modachem Shanghai Co., Ltd
|
Tel: |
+86 (0)21 51320687 51371369 1744605818 |
Website: |
www.chemicalbook.com/ShowSupplierProductsList16334/0_EN.htm |
|