ChemicalBook--->CAS DataBase List--->1398507-08-8

1398507-08-8

1398507-08-8 Structure

1398507-08-8 Structure
IdentificationBack Directory
[Name]

4-(4-aMino-6-chloropyriMidin-2-ylaMino)benzonitrile
[CAS]

1398507-08-8
[Synonyms]

4-(4-aMino-6-chloropyriMidin-2-ylaMino)benzonitrile
4-[(4-amino-6-chloro-2-pyrimidinyl)amino]benzonitrile
[Molecular Formula]

C11H8ClN5
[MDL Number]

MFCD24682776
[MOL File]

1398507-08-8.mol
[Molecular Weight]

245.668
Chemical PropertiesBack Directory
[storage temp. ]

under inert gas (nitrogen or Argon) at 2–8 °C
Hazard InformationBack Directory
[Synthesis]

4-Amino-2,6-dichloropyrimidine

10132-07-7

4-Aminobenzonitrile

873-74-5

4-(4-aMino-6-chloropyriMidin-2-ylaMino)benzonitrile

1398507-08-8

Example 7: Preparation of 4-(4-amino-6-chloropyrimidin-2-ylamino)benzonitrile (Compound Ia) To a solution of 4-aminobenzonitrile (ABN; 7 g; 59.3 mmol) in 2-butanol (190 ml) was slowly added 2,6-dichloropyrimidin-4-amine (DCAP; 10.2 g; 62.2 mmol) at room temperature. The resulting suspension was heated to reflux (102 °C) and stirred continuously for 20 hours. Upon completion of the reaction, the suspension was cooled to 20-25 °C and stirring was continued for 1 h at this temperature. The solid product was separated by filtration, washed with 2-butanol (20 ml) and subsequently dried at 50 °C for 2 h at 10 mbar. The final product was 12.20 g of 4-(4-amino-6-chloropyrimidin-2-ylamino)benzonitrile hydrochloride in 73.0% yield. The purity of the product was analyzed by HPLC/MS as 99.0 area%.

[References]

[1] Patent: WO2013/59572, 2013, A1. Location in patent: Page/Page column 17; 18
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