7-(3-Bromopropyl)-3,7-Dihydro-1,3-Dimethyl-1H-Purine-2,6-Dione
[CAS# 23146-06-7]

Identification

• Name: 7-(3-Bromopropyl)-3,7-Dihydro-1,3-Dimethyl-1H-Purine-2,6-Dione
• Synonyms: 7-(3-Bromopropyl)-1,3-Dimethyl-Purine-2,6-Dione; 7-(3-Bromopropyl)-1,3-Dimethyl-Xanthine; Zinc02029083
• Molecular Formula: C₁₀H₁₃BrN₄O₂
• Molecular Weight: 301.14
• CAS Registry Number: 23146-06-7
• EINECS: 245-455-8
• SMILES: C1=NC2=C([N]1CCCBr)C(=O)N(C(=O)N2C)C
• InChI: 1S/C10H13BrN4O2/c1-13-8-7(9(16)14(2)10(13)17)15(6-12-8)5-3-4-11/h6H,3-5H2,1-2H3
• InChIKey: IXYPCFPAFIVIGP-UHFFFAOYSA-N

Properties

• Density: 1.681g/cm³ (Cal.)
• Boiling point: 484.7°C at 760 mmHg (Cal.)
• Flash point: 246.938°C (Cal.)