9-(4-Methoxyphenyl)Purine-2,6-Diamine
[CAS# 49753-42-6]

Identification

• Name: 9-(4-Methoxyphenyl)Purine-2,6-Diamine
• Synonyms: [2-Amino-9-(4-Methoxyphenyl)Purin-6-Yl]Amine; Nci60_004093; Nsc46387
• Molecular Formula: C₁₂H₁₂N₆O
• Molecular Weight: 256.27
• CAS Registry Number: 49753-42-6
• SMILES: C1=NC3=C([N]1C2=CC=C(C=C2)OC)N=C(N)N=C3N
• InChI: 1S/C12H12N6O/c1-19-8-4-2-7(3-5-8)18-6-15-9-10(13)16-12(14)17-11(9)18/h2-6H,1H3,(H4,13,14,16,17)
• InChIKey: QJNZHIBMALXZSJ-UHFFFAOYSA-N

Properties

• Density: 1.559g/cm³ (Cal.)
• Boiling point: 599.58°C at 760 mmHg (Cal.)
• Flash point: 316.415°C (Cal.)