2-(4-N-Butylanilino)Adenine
[CAS# 99304-81-1]

Identification

• Name: 2-(4-N-Butylanilino)Adenine
• Synonyms: (6-Amino-7H-Purin-2-Yl)-(4-Butylphenyl)Amine; Nci60_030849; Aids-149925
• Molecular Formula: C₁₅H₁₈N₆
• Molecular Weight: 282.35
• CAS Registry Number: 99304-81-1
• SMILES: C2=NC1=NC(=NC(=C1[NH]2)N)NC3=CC=C(C=C3)CCCC
• InChI: 1S/C15H18N6/c1-2-3-4-10-5-7-11(8-6-10)19-15-20-13(16)12-14(21-15)18-9-17-12/h5-9H,2-4H2,1H3,(H4,16,17,18,19,20,21)
• InChIKey: JSFFGFGRNFFOGA-UHFFFAOYSA-N

Properties

• Density: 1.309g/cm³ (Cal.)
• Boiling point: 606.514°C at 760 mmHg (Cal.)
• Flash point: 320.608°C (Cal.)