2-(8-Bromo-1,3-Dimethyl-2,6-Dioxopurin-7-Yl)Acetaldehyde
[CAS# 111038-29-0]

Identification

• Name: 2-(8-Bromo-1,3-Dimethyl-2,6-Dioxopurin-7-Yl)Acetaldehyde
• Synonyms: 2-(8-Bromo-1,3-Dimethyl-2,6-Dioxo-Purin-7-Yl)Acetaldehyde; 2-(8-Bromo-1,3-Dimethyl-2,6-Dioxo-7-Purinyl)Acetaldehyde; 2-(8-Bromo-2,6-Diketo-1,3-Dimethyl-Purin-7-Yl)Acetaldehyde
• Molecular Formula: C₉H₉BrN₄O₃
• Molecular Weight: 301.10
• CAS Registry Number: 111038-29-0
• SMILES: C([N]1C(=NC2=C1C(N(C(N2C)=O)C)=O)Br)C=O
• InChI: 1S/C9H9BrN4O3/c1-12-6-5(7(16)13(2)9(12)17)14(3-4-15)8(10)11-6/h4H,3H2,1-2H3
• InChIKey: SSTGBMCLNGQXNF-UHFFFAOYSA-N

Properties

• Density: 1.878g/cm³ (Cal.)
• Boiling point: 484.572°C at 760 mmHg (Cal.)
• Flash point: 246.86°C (Cal.)