ChemicalBook--->CAS DataBase List--->1005-37-4

1005-37-4

1005-37-4 Structure

1005-37-4 Structure
IdentificationBack Directory
[Name]

NSC36831
[CAS]

1005-37-4
[Synonyms]

NSC36831
Methyl-2,4-pyriMidinediaMine
2-amino-4-methylamino-6-chloropyrimidine
6-chloro-N'-methylpyrimidine-2,4-diamine
6-chloro-N'-methyl-pyrimidine-2,4-diamine
(2-amino-6-chloro-pyrimidin-4-yl)-methyl-amine
6-Chloro-N4-methylpyrimidine-2,4-diaminevfc'b'g
6-chloro-N~4~-methyl-2,4-pyrimidinediamine(SALTDATA: FREE)
[Molecular Formula]

C5H7ClN4
[MDL Number]

MFCD02091108
[MOL File]

1005-37-4.mol
[Molecular Weight]

158.59
Chemical PropertiesBack Directory
[storage temp. ]

under inert gas (nitrogen or Argon) at 2–8 °C
[form ]

solid
[color ]

Yellow
Safety DataBack Directory
[HazardClass ]

IRRITANT
[HS Code ]

2933599590
Spectrum DetailBack Directory
[Spectrum Detail]

NSC36831(1005-37-4)1HNMR
Hazard InformationBack Directory
[Synthesis]

2-Amino-4,6-dichloropyrimidine

56-05-3

Methylamine

74-89-5

NSC36831

1005-37-4

The general procedure for the synthesis of 6-chloro-N4-methylpyrimidine-2,4-diamine from 2-amino-4,6-dichloropyrimidine and methylamine was as follows: first, 4,6-dichloropyrimidin-2-amine (3.28 g, 20.0 mmol), methylamine (12.0 mL, 24.0 mmol as a 2M methanol solution), and Hunig's base in n-butanol (20 mL) were The mixture was heated to 50 °C and then warmed to 95 °C for overnight reaction. After completion of the reaction, the mixture was concentrated and the crude product was dissolved in ethyl acetate (300 mL) and washed with water (3 x 150 mL). The organic layer was dried with magnesium sulfate, filtered and concentrated to afford the target product 6-chloro-N4-methylpyrimidine-2,4-diamine (2.90 g, 91% yield) as a light yellow solid.LCMS analysis showed the [M + H]+ peak as 159.

[References]

[1] Patent: WO2015/187089, 2015, A1. Location in patent: Page/Page column 70
[2] Patent: CN108191774, 2018, A. Location in patent: Paragraph 0203; 0204; 0205
[3] Patent: US6677345, 2004, B1. Location in patent: Page/Page column 12
[4] Patent: WO2010/120854, 2010, A1. Location in patent: Page/Page column 87
[5] Journal of Medicinal Chemistry, 2011, vol. 54, # 6, p. 1871 - 1895
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