2-Methylsulfanyl-7H-Purine
[CAS# 33512-51-5]

Identification

• Name: 2-Methylsulfanyl-7H-Purine
• Synonyms: 2-(Methylthio)-7H-Purine; Nsc23724; Purine, 2-(Methylthio)-
• Molecular Formula: C₆H₆N₄S
• Molecular Weight: 166.20
• CAS Registry Number: 33512-51-5
• SMILES: C1=NC(=NC2=C1[NH]C=N2)SC
• InChI: 1S/C6H6N4S/c1-11-6-7-2-4-5(10-6)9-3-8-4/h2-3H,1H3,(H,7,8,9,10)
• InChIKey: GEVCSRLIETZLTD-UHFFFAOYSA-N

Properties

• Density: 1.473g/cm³ (Cal.)
• Boiling point: 519.469°C at 760 mmHg (Cal.)
• Flash point: 267.965°C (Cal.)

References

• (1): Teemu Nissilä, Lauri Sainiemi, Mika-Matti Karikko, Marianna Kemell, Mikko Ritala, Sami Franssila, Risto Kostiainen and Raimo A. Ketola. Integrated photocatalytic micropillar nanoreactor electrospray ionization chip for mimicking phase I metabolic reactions, Lab Chip, 2011, 11, 1470.