2-Bromo-9-(2-deoxypentofuranosyl)-9H-purin-6-amine
[CAS# 89178-21-2]

Identification

• Name: 2-Bromo-9-(2-deoxypentofuranosyl)-9H-purin-6-amine
• Synonyms: 5-(6-amino-2-bromo-9H-purin-9-yl)-2-(hydroxymethyl)oxolan-3-ol; adenosine, 2-bromo-2'-deoxy-; NSC341936
• Molecular Formula: C₁₀H₁₂BrN₅O₃
• Molecular Weight: 330.14
• CAS Registry Number: 89178-21-2
• SMILES: C1C(C(OC1N2C=NC3=C(N=C(N=C32)Br)N)CO)O
• InChI: 1S/C10H12BrN5O3/c11-10-14-8(12)7-9(15-10)16(3-13-7)6-1-4(18)5(2-17)19-6/h3-6,17-18H,1-2H2,(H2,12,14,15)
• InChIKey: UYDKYWTWCPKLJR-UHFFFAOYSA-N

Properties

• Density: 2.3±0.1g/cm³ (Cal.)
• Boiling point: 717.2±70.0°C at 760 mmHg (Cal.)
• Flash point: 387.5±35.7°C (Cal.)