| Identification | More | [Name]
4,6-Dichloro-5-methylpyrimidine | [CAS]
4316-97-6 | [Synonyms]
4,6-DICHLORO-5-METHYLPYRIMIDINE | [Molecular Formula]
C5H4Cl2N2 | [MDL Number]
MFCD01646112 | [Molecular Weight]
163 | [MOL File]
4316-97-6.mol |
| Chemical Properties | Back Directory | [Appearance]
White Solid | [Melting point ]
56-60 °C (lit.) | [storage temp. ]
Inert atmosphere,2-8°C | [solubility ]
soluble in Methanol | [form ]
powder to crystal | [color ]
White to Light yellow to Light orange | [InChI]
1S/C5H4Cl2N2/c1-3-4(6)8-2-9-5(3)7/h2H,1H3 | [InChIKey]
NUEYDUKUIXVKNB-UHFFFAOYSA-N | [SMILES]
Cc1c(Cl)ncnc1Cl | [CAS DataBase Reference]
4316-97-6(CAS DataBase Reference) |
| Safety Data | Back Directory | [Hazard Codes ]
C | [Risk Statements ]
R34:Causes burns. | [Safety Statements ]
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) . | [RIDADR ]
UN 3261 8/PG 2
| [WGK Germany ]
3
| [HazardClass ]
8 | [HazardClass ]
CORROSIVE | [HS Code ]
29335990 | [Storage Class]
8A - Combustible corrosive hazardous materials | [Hazard Classifications]
Eye Dam. 1
Skin Corr. 1B |
| Hazard Information | Back Directory | [Chemical Properties]
White Solid | [Synthesis]
General procedure for the synthesis of 4,6-dichloro-5-methylpyrimidine from 5-methylpyrimidine-4,6-diol: To a solution of POCl3 (1.9 mol, 174 mL) containing the pyrimidine derivative (0.38 mol, 1 eq.) was slowly added DMF (0.152 mol, 11.7 mL), noting that this process is exothermic. The reaction mixture was heated to reflux and maintained for 3 hours. Upon completion of the reaction, it was cooled to room temperature and the mixture was carefully poured into an ice/water mixture. The precipitated white solid product was collected by filtration, washed well with water and subsequently dried under vacuum to afford 4,6-dichloro-5-methylpyrimidine (1) in 90% yield. | [References]
[1] Patent: US2006/155129, 2006, A1. Location in patent: Page/Page column 14
[2] Patent: EP1333029, 2003, A1 |
| Questions And Answer | Back Directory | [Application]
4,6-Dichloro-5-methylpyrimidine is a heterocyclic organic compound that can be used as an intermediate in organic synthesis. |
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