9-Benzyl-6-Benzylsulfanyl-Purin-2-Amine
[CAS# 94333-07-0]

Identification

• Name: 9-Benzyl-6-Benzylsulfanyl-Purin-2-Amine
• Synonyms: 9-(Phenylmethyl)-6-(Phenylmethylthio)-2-Purinamine; [9-(Benzyl)-6-(Benzylthio)Purin-2-Yl]Amine; Nci42384
• Molecular Formula: C₁₉H₁₇N₅S
• Molecular Weight: 347.44
• CAS Registry Number: 94333-07-0
• SMILES: C3=NC1=C(N=C(N)N=C1SCC2=CC=CC=C2)[N]3CC4=CC=CC=C4
• InChI: 1S/C19H17N5S/c20-19-22-17-16(18(23-19)25-12-15-9-5-2-6-10-15)21-13-24(17)11-14-7-3-1-4-8-14/h1-10,13H,11-12H2,(H2,20,22,23)
• InChIKey: DNNVKRLIFZPYGL-UHFFFAOYSA-N

Properties

• Density: 1.333g/cm³ (Cal.)
• Boiling point: 636.777°C at 760 mmHg (Cal.)
• Flash point: 338.911°C (Cal.)