6-(Dimethylamino)-9-(4-Methylbenzyl)-2-(Trifluoromethyl)-9H-Purine
[CAS# 117860-34-1]

Identification

• Name: 6-(Dimethylamino)-9-(4-Methylbenzyl)-2-(Trifluoromethyl)-9H-Purine
• Synonyms: N,N-Dimethyl-9-[(4-Methylphenyl)Methyl]-2-(Trifluoromethyl)-6-Purinamine; Dimethyl-[9-(4-Methylbenzyl)-2-(Trifluoromethyl)Purin-6-Yl]Amine; Aids-187006
• Molecular Formula: C₁₆H₁₆F₃N₅
• Molecular Weight: 335.33
• CAS Registry Number: 117860-34-1
• SMILES: C1=CC(=CC=C1C[N]3C2=NC(=NC(=C2N=C3)N(C)C)C(F)(F)F)C
• InChI: 1S/C16H16F3N5/c1-10-4-6-11(7-5-10)8-24-9-20-12-13(23(2)3)21-15(16(17,18)19)22-14(12)24/h4-7,9H,8H2,1-3H3
• InChIKey: CGYQALAEDMYLCQ-UHFFFAOYSA-N

Properties

• Density: 1.332g/cm³ (Cal.)
• Boiling point: 376.656°C at 760 mmHg (Cal.)
• Flash point: 181.595°C (Cal.)