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1007-11-0

1007-11-0 Structure

1007-11-0 Structure
IdentificationBack Directory
[Name]

2,4-pyrimidinediamine, 6-chloro-N~4~,N~4~-dimethyl-
[CAS]

1007-11-0
[Synonyms]

6-chloro-N',N'-dimethylpyrimidine-2,4-diamine
6-chloro-N',N'-dimethyl-pyrimidine-2,4-diamine
6-chloro-4-N,4-N-dimethylpyrimidine-2,4-diamine
(2-amino-6-chloro-pyrimidin-4-yl)-dimethyl-amine
2-Amino-6-chloro-4-(dimethylamino)pyrimidine, 97%
6-chloro-N~4~,N~4~-dimethylpyrimidine-2,4-diamine
6-chloro-N~4~,N~4~-dimethyl-2,4-pyrimidinediamine
2,4-pyrimidinediamine, 6-chloro-N~4~,N~4~-dimethyl-
6-chloro-N~4~,N~4~-dimethyl-2,4-pyrimidinediamine(SALTDATA: FREE)
[Molecular Formula]

C6H9ClN4
[MDL Number]

MFCD13188630
[MOL File]

1007-11-0.mol
[Molecular Weight]

172.62
Chemical PropertiesBack Directory
[Boiling point ]

384.4±45.0 °C(Predicted)
[density ]

1.347±0.06 g/cm3(Predicted)
[storage temp. ]

under inert gas (nitrogen or Argon) at 2-8°C
[pka]

4.00±0.10(Predicted)
[Appearance]

Off-white to light yellow Solid
Safety DataBack Directory
[HazardClass ]

IRRITANT
[HS Code ]

2933599590
Hazard InformationBack Directory
[Synthesis]

2-Amino-4,6-dichloropyrimidine

56-05-3

Dimethylamine

124-40-3

2,4-pyrimidinediamine, 6-chloro-N~4~,N~4~-dimethyl-

1007-11-0

General procedure for the synthesis of 6-chloro-N4,N4-dimethylpyrimidine-2,4-diamine from 2-amino-4,6-dichloropyrimidine and dimethylamine: to an acetonitrile solution of 2-amino-4,6-dichloropyrimidine (2.0 g, 12.2 mmol) was added sequentially N,N-diisopropylethylamine (Hunig base, 2.34 mL, 13.4 mmol) and dimethylamine ( 6.7 mL, 13.4 mmol). The reaction mixture was stirred at 50°C for 1.5 hours. Upon completion of the reaction, the mixture was cooled to 0 °C and poured into a mixture of dichloromethane and water. The organic layer was separated, washed with saturated saline, and the organic phase was concentrated to afford 6-chloro-N4,N4-dimethylpyrimidine-2,4-diamine (2.2 g, 94% yield) as an off-white solid.LC-MS (electrospray ionization) m/z = 173,175 [M + H]+.

[References]

[1] Patent: WO2010/59658, 2010, A1. Location in patent: Page/Page column 121
[2] Journal of the American Chemical Society, 1951, vol. 73, p. 3011
[3] Journal of the Chemical Society, 1957, p. 2151
[4] Journal of the Chemical Society, 1952, p. 1532
[5] Organic Magnetic Resonance, 1982, vol. 20, # 4, p. 274 - 275
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