4-[(2-Amino-5-bromo-6-methylpyrimidin-4-yl)amino]benzonitrile

Base Information

• Chemical Name: 4-[(2-Amino-5-bromo-6-methylpyrimidin-4-yl)amino]benzonitrile
• CAS No.: 6303-42-0
• Molecular Formula: C12H10 Br N5
• Molecular Weight: 304.15
• NSC Number: 43271
• DSSTox Substance ID: DTXSID80285939
• Wikidata: Q82021491
• ChEMBL ID: CHEMBL1905747
• Mol file: 6303-42-0.mol

Synonyms:6303-42-0;4-[(2-amino-5-bromo-6-methylpyrimidin-4-yl)amino]benzonitrile;MLS000737076;4-((2-Amino-5-bromo-6-methylpyrimidin-4-yl)amino)benzonitrile;4-[(2-AMINO-5-BROMO-6-METHYL-PYRIMIDIN-4-YL)AMINO]BENZONITRILE;NSC43271;CHEMBL1905747;DTXSID80285939;HMS2759A24;NSC-43271;SMR000394030

Chemical Property of 4-[(2-Amino-5-bromo-6-methylpyrimidin-4-yl)amino]benzonitrile

Chemical Property:

• Vapor Pressure: 5.89E-11mmHg at 25°C
• Boiling Point: 521.1°C at 760 mmHg
• Flash Point: 268.9°C
• PSA: 87.62000
• Density: 1.63g/cm³
• LogP: 3.39918
• XLogP3: 2.5
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 2
• Exact Mass: 303.01196
• Heavy Atom Count: 18
• Complexity: 320

Purity/Quality:

99%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C(=NC(=N1)N)NC2=CC=C(C=C2)C#N)Br