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6-Amino-2-pyrazinecarbonitrile

6-Amino-2-pyrazinecarbonitrile structure

6-Amino-2-pyrazinecarbonitrile 

structure
  • CAS No:

    59489-39-3

  • Formula:

    C5H4N4

  • Chemical Name:

    6-Amino-2-pyrazinecarbonitrile

  • Synonyms:

    2-Pyrazinecarbonitrile,6-amino-;Pyrazinecarbonitrile,6-amino-;6-Amino-2-pyrazinecarbonitrile;2-Amino-6-cyanopyrazine;2-Amino-6-pyrazinecarbonitrile

  • Categories:

    Pharmaceutical Intermediates  >  Heterocyclic Compound

6-Amino-2-pyrazinecarbonitrile Basic Attributes

120.11206

120.11

DTXSID00608803

2933990090

Characteristics

75.6

-0.5

1.3±0.1 g/cm3

367.8°C at 760 mmHg

176.3±26.5 °C

1.600

6-Amino-2-pyrazinecarbonitrile Use and Manufacturing

To a solution of 3, 5-dibromo-6- chloropyrazin-2-amine (Rz = Cl) was prepared according to Organic Letters, 17(15), 3888- 3891; 2015. 6-amino-3, 5-dibromopyrazine-2-carbonitrile (Rz = CN) was prepared as follows.6-Aminopyrazine-2-carbonitrile (ig, 8.3 mmol) was dissolved in dichloromethane (15 mL). To this solution, NBS (2.96g, 16.65 mmol, 2 eq.) was added, and the reaction mixture was stirred at room temperature overnight (16 h). The reaction mixture was poured into water and extracted with dichloromethane, dried over MgSO4, filtered, and concentrated under reduced pressure. The residue was purified using silica gel chromatography with Heptane/EtOAc as eluent providing 6-amino-3, 5-dibromopyrazine-2-carbonitrile (Rz = CN)Intermediate 5 (500 mg, 1.13 mmol) ,

Computed Properties

Molecular Weight:120.11
XLogP3:-0.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Exact Mass:120.043596145
Monoisotopic Mass:120.043596145
Topological Polar Surface Area:75.6
Heavy Atom Count:9
Complexity:135
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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