1,3-Dimethyl-7-(²H₃)Methyl-7,9-Dihydro-1H-Purine-2,6,8(3H)-Trione
[CAS# 188297-95-2]

Identification

• Name: 1,3-Dimethyl-7-(²H₃)Methyl-7,9-Dihydro-1H-Purine-2,6,8(3H)-Trione
• Synonyms: 1,3,7-Trimethyluric Acid-d3
• Molecular Formula: C₈H₇D₃N₄O₃
• Molecular Weight: 213.21
• CAS Registry Number: 188297-95-2
• SMILES: [2H]C([2H])([2H])n1c2c(nc1O)n(c(=O)n(c2=O)C)C
• InChI: 1S/C8H10N4O3/c1-10-4-5(9-7(10)14)11(2)8(15)12(3)6(4)13/h1-3H3,(H,9,14)/i1D3
• InChIKey: BYXCFUMGEBZDDI-FIBGUPNXSA-N

Properties

• Density: 1.631g/cm³ (Cal.)
• Boiling point: 476.686°C at 760 mmHg (Cal.)
• Flash point: 242.091°C (Cal.)
• Refractive index: 1.713 (Cal.)