2,8-Dichloro-1H-Adenine
[CAS# 2914-09-2]

Identification

• Name: 2,8-Dichloro-1H-Adenine
• Synonyms: (2,8-Dichloro-7H-Purin-6-Yl)Amine; 2,8-Dichloro-1H-Adenine
• Molecular Formula: C₅H₃Cl₂N₅
• Molecular Weight: 204.02
• CAS Registry Number: 2914-09-2
• EINECS: 220-827-2
• SMILES: C2(=NC(=C1[NH]C(=NC1=N2)Cl)N)Cl
• InChI: 1S/C5H3Cl2N5/c6-4-9-1-2(8)10-5(7)12-3(1)11-4/h(H3,8,9,10,11,12)
• InChIKey: KTWHRTDJQIMWMY-UHFFFAOYSA-N

Properties

• Density: 1.894g/cm³ (Cal.)
• Boiling point: 378.759°C at 760 mmHg (Cal.)
• Flash point: 182.867°C (Cal.)